N-(2,3-dimethylphenyl)-2-({6-[(4-methylphenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-({6-[(4-methylphenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
N-(2,3-dimethylphenyl)-2-({6-[(4-methylphenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E140-0181 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-({6-[(4-methylphenyl)methyl]-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 448.59 |
| Molecular Formula: | C25 H28 N4 O2 S |
| Smiles: | Cc1ccc(CN2CCC3=C(C2)C(NC(=N3)SCC(Nc2cccc(C)c2C)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5871 |
| logD: | 3.0377 |
| logSw: | -3.5599 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.397 |
| InChI Key: | KSOPTQQTIBHVAY-UHFFFAOYSA-N |