N~2~-[(4-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N~2~-[(4-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
N~2~-[(4-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V002-8285 |
| Compound Name: | N~2~-[(4-cyanophenyl)carbamoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide |
| Molecular Weight: | 576.72 |
| Molecular Formula: | C31 H36 N4 O5 S |
| Smiles: | Cc1ccc(CN(CCc2ccc(c(c2)OC)OC)C(CN(CC2CCCO2)C(Nc2ccc(C#N)cc2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8701 |
| logD: | 3.8701 |
| logSw: | -4.0289 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.65 |
| InChI Key: | ALJWLWSQFMHVSC-AREMUKBSSA-N |