N-[(4-methylphenyl)methyl]-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
N-[(4-methylphenyl)methyl]-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide
Compound characteristics
| Compound ID: | C173-0499 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)propanamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | Cc1ccc(CNC(CCC2NC(c3c4CCCCc4sc3N=2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3293 |
| logD: | 3.3287 |
| logSw: | -3.8175 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.195 |
| InChI Key: | BMIYTJQXDZEWCE-UHFFFAOYSA-N |