![C33H39N5O6 L-Ornithinamide, N-[(9H-fluairéin-9-ilmeatocsa)carbóinil]-L-valil-N5-(aimíncharbóinil)-N-[4-(hiodrocsaimeitil)feinil]- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C33H39N5O6 L-Ornithinamide, N-[(9H-fluairéin-9-ilmeatocsa)carbóinil]-L-valil-N5-(aimíncharbóinil)-N-[4-(hiodrocsaimeitil)feinil]- (9CI, ACI) Íomhá Réadmhaoin](https://cdn.globalso.com/nvchem/C33H39N5O6-L-Ornithinamide.jpg)
C33H39N5O6 L-Ornithinamide, N-[(9H-fluairéin-9-ilmeatocsa)carbóinil]-L-valil-N5-(aimíncharbóinil)-N-[4-(hiodrocsaimeitil)feinil]- (9CI, ACI)
| Príomhairíonna Fisiceacha | Luach | Coinníoll |
| Meáchan Móilíneach | 601.69 | - |
| Fiuchphointe (Tuartha) | 914.2±65.0 °C | Brúigh: 760 Torr |
| Dlús (Tuartha) | 1.276±0.06 g/cm3 | Teocht: 20 °C; Brú: 760 Torr |
| pKa (Tuartha) | 10.63±0.46 | Teocht is Aigéadaí: 25 °C |
AOIBHÍ Canónacha O=C(OCC1C=2C=CC=CC2C=3C=CC=CC31)NC(C(=O)NC(C(=O)NC4=CC=C(C=C4)CO)CCCNC(=O)N)C(C)C
Isiméireacha SMILES C(OC(N[C@H](C(N[C@H](C(NC1=CC=C(CO)C=C1)=O)CCCNC(N)=O)=O)[C@H](C)C)=O)C2C=3C(C=4C2=CC=CC4)=CC=CC3
InChI
InChI=1S/C33H39N5O6/c1-20(2)29(38-33(43)44-19-27-25-10-5-3-8-23(25)24-9-4-6-11-26(24)27)31(41()37-28-21 32(34)42)30(40)36-22-15-13-21(18-39)14-16-22/h3-6,8-11,13-16,20, 27-29,39H,7,12,17-19H2,1-2H3,(H,36,40)(H,37,41)(H,38,43)(H3,34,3
5,42)/t28-,29-/m0/s1
Eochair InChI
DALMAZHDNFCDRP-VMPREFPWSA-N
1 Ainm Eile don tSubstaint seo
N-[(9H-Fluairéin-9-ilmeatocsa)carbóinil]-L-valil-N5-(aimíncharbóinil)-N-[4-(hiodrocsaimeitil)feinil]-L-ornítíanaimíd (ACI)
Speictrim atá ar fáil
1H NMR
13C NMR
| Maoine atá ar fáil |
| Bitheolaíoch |
| Ceimiceach |
| Dlús |
| Lipinski |
| Struchtúr Gaolmhar |
| Teirmeach |
Bitheolaíoch
| Maoin | Luach | Coinníoll | Foinse |
| Fachtóir Bith-thiúchana | 809 | pH 1; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 912 | pH 2; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 923 | pH 3; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 924 | pH 4; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 924 | pH 5; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 924 | pH 6; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 924 | pH 7; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 922 | pH 8; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 903 | pH 9; Teocht: 25 °C | (1) ACD |
| Fachtóir Bith-thiúchana | 750 | pH 10; Teocht: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Ceimiceach
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 4040 | pH 1; Teocht: 25 °C | (1) ACD |
| Koc | 4550 | pH 2; Teocht: 25 °C | (1) ACD |
| Koc | 4610 | pH 3; Teocht: 25 °C | (1) ACD |
| Koc | 4620 | pH 4; Teocht: 25 °C | (1) ACD |
| Koc | 4620 | pH 5; Teocht: 25 °C | (1) ACD |
| Koc | 4620 | pH 6; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Koc | 4620 | pH 7; Teocht: 25 °C | (1) ACD |
| Koc | 4610 | pH 8; Teocht: 25 °C | (1) ACD |
| Koc | 4510 | pH 9; Teocht: 25 °C | (1) ACD |
| Koc | 3740 | pH 10; Teocht: 25 °C | (1) ACD |
| logD | 4.15 | pH 1; Teocht: 25 °C | (1) ACD |
| logD | 4.20 | pH 2; Teocht: 25 °C | (1) ACD |
| logD | 4.20 | pH 3; Teocht: 25 °C | (1) ACD |
| logD | 4.20 | pH 4; Teocht: 25 °C | (1) ACD |
| logD | 4.21 | pH 5; Teocht: 25 °C | (1) ACD |
| logD | 4.21 | pH 6; Teocht: 25 °C | (1) ACD |
| logD | 4.20 | pH 7; Teocht: 25 °C | (1) ACD |
| logD | 4.20 | pH 8; Teocht: 25 °C | (1) ACD |
| logD | 4.19 | pH 9; Teocht: 25 °C | (1) ACD |
| logD | 4.11 | pH 10; Teocht: 25 °C | (1) ACD |
| logP | 4.206±0.767 | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mais | 1.7 x 10-4 g/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 2.0 x 10-4 g/L | pH 1; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 2; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 4; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 2.1 x 10-4 g/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mais | 1.7 x 10-4 g/L | Uisce Gan Maolán pH 7.00; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Intreach Mhólar | 2.9 x 10-7 móil/L | Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 3.3 x 10-7 móil/L | pH 1; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 2; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 3; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 4; Teocht: 25 °C | (1) ACD |
| Maoin | Luach | Coinníoll | Foinse |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 5; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 6; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 7; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 8; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | pH 9; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 3.5 x 10-7 móil/L | pH 10; Teocht: 25 °C | (1) ACD |
| Intuaslagthacht Mhólar | 2.9 x 10-7 móil/L | Uisce Gan Maolán pH 7.00; Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 601.69 | ||
| pKa | 10.63±0.46 | Teocht is Aigéadaí: 25 °C | (1) ACD |
| pKa | 0.13±0.50 | Teocht is Bunúsaí: 25 °C | (1) ACD |
| Brú Gaile | 0 Torr | Teocht: 25 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Dlús
| Maoin | Luach | Coinníoll | Foinse |
| Dlús | 1.276±0.06 g/cm3 | Teocht: 20 °C; Brú: 760 Torr | (1) ACD |
| Toirt Mhólach | 471.2±3.0 cm3/mol | Teocht: 20 °C; Brú: 760 Torr | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Maoin | Luach | Coinníoll | Foinse |
| Bannaí Rothlach Saor in Aisce | 15 | (1) ACD | |
| Glacadóirí H | 11 | (1) ACD | |
| Deontóirí H | 7 | (1) ACD | |
| Suim an Deontóra/Glacadóra H | 18 | (1) ACD | |
| logP | 4.206±0.767 | Teocht: 25 °C | (1) ACD |
| Meáchan Móilíneach | 601.69 |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Struchtúr Gaolmhar
| Maoin | Luach | Coinníoll | Foinse |
| Achar Dromchla Polach | 172 A2 | (1) ACD | |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Teirmeach
| Maoin | Luach | Coinníoll | Foinse |
| Fiuchphointe | 914.2±65.0 °C | Brúigh: 760 Torr | (1) ACD |
| Eintalpacht Galúcháin | 139.25±3.0 kJ/mol | Brúigh: 760 Torr | (1) ACD |
| Pointe Splanc | 506.7±34.3 °C | (1) ACD |
(1) Ríomhtha ag baint úsáide as Bogearraí Advanced Chemistry Development (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
Speictrim atá ar fáil
1H NMR
13C NMR
![C17H19N3O6 Tímidín, α-ocsó-α-[(feinilmeitil)aimín]- (ACI)](https://cdn.globalso.com/nvchem/C17H19N3O6-Thymidine-300x300.png)
![C41H51N5O8Si Guanosine, 5′-O-[bis(4-meatocsafeinil)feinilmeitil]-2′-O-[(1,1-démheitileitile)démheitilsilil]-N-(2-meitil-1-ocsapróipil)- (9CI, ACI)](https://cdn.globalso.com/nvchem/C41H51N5O8Si-Guanosine-300x300.jpg)
