N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(propan-2-yl)-N-[(thiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(propan-2-yl)-N-[(thiophen-2-yl)methyl]glycinamide
N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(propan-2-yl)-N-[(thiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V001-1419 |
| Compound Name: | N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(propan-2-yl)-N-[(thiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 520.65 |
| Molecular Formula: | C28 H32 N4 O4 S |
| Smiles: | CC(C)N(CC(N(CCc1ccc(c(c1)OC)OC)Cc1cccs1)=O)C(Nc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2061 |
| logD: | 4.2061 |
| logSw: | -4.2517 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.011 |
| InChI Key: | JXEIATJRYMMLKG-UHFFFAOYSA-N |