N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(3-ethoxypropyl)-N-[(5-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(3-ethoxypropyl)-N-[(5-methylthiophen-2-yl)methyl]glycinamide
N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(3-ethoxypropyl)-N-[(5-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V001-1148 |
| Compound Name: | N~2~-[(3-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(3-ethoxypropyl)-N-[(5-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 578.73 |
| Molecular Formula: | C31 H38 N4 O5 S |
| Smiles: | CCOCCCN(CC(N(CCc1ccc(c(c1)OC)OC)Cc1ccc(C)s1)=O)C(Nc1cccc(C#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.526 |
| logD: | 4.526 |
| logSw: | -4.2822 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.224 |
| InChI Key: | USOVOBKZJWURPW-UHFFFAOYSA-N |