6-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
6-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0138 |
| Compound Name: | 6-benzyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 377.51 |
| Molecular Formula: | C22 H23 N3 O S |
| Smiles: | Cc1ccc(CSC2NC(C3CN(CCC=3N=2)Cc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2811 |
| logD: | 2.8797 |
| logSw: | -3.4024 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.946 |
| InChI Key: | DXKRVKMESIXXEX-UHFFFAOYSA-N |