2-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0172 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 415.92 |
| Molecular Formula: | C21 H19 Cl F N3 O S |
| Smiles: | C1CN(CC2=C1N=C(NC2=O)SCc1ccc(cc1)[Cl])Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.4815 |
| logD: | 3.08 |
| logSw: | -3.9511 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.946 |
| InChI Key: | WMPPKLRFTCSPBA-UHFFFAOYSA-N |