6-[(4-chlorophenyl)methyl]-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(4-chlorophenyl)methyl]-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
6-[(4-chlorophenyl)methyl]-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | L872-0032 |
Compound Name: | 6-[(4-chlorophenyl)methyl]-2-{[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
Molecular Weight: | 479 |
Molecular Formula: | C25 H23 Cl N4 O2 S |
Smiles: | Cc1c(CSC2NC(C3CN(CCC=3N=2)Cc2ccc(cc2)[Cl])=O)nc(c2ccccc2)o1 |
Stereo: | ACHIRAL |
logP: | 4.257 |
logD: | 3.729 |
logSw: | -4.5702 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.068 |
InChI Key: | XZOVKHMEMVFEQE-UHFFFAOYSA-N |