2-{[(2-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-6-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | L872-0170 |
Compound Name: | 2-{[(2-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)SCc1ccccc1[Cl])Cc1ccc(cc1)F |
Stereo: | ACHIRAL |
logP: | 3.8231 |
logD: | 3.5126 |
logSw: | -4.2504 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 37.946 |
InChI Key: | JEZNZKDQYGTHJL-UHFFFAOYSA-N |