2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-6-[(4-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-6-[(4-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-6-[(4-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | L872-0199 |
Compound Name: | 2-{[(3,4-dimethylphenyl)methyl]sulfanyl}-6-[(4-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
Molecular Weight: | 421.56 |
Molecular Formula: | C24 H27 N3 O2 S |
Smiles: | Cc1ccc(CSC2NC(C3CN(CCC=3N=2)Cc2ccc(cc2)OC)=O)cc1C |
Stereo: | ACHIRAL |
logP: | 4.0955 |
logD: | 3.6941 |
logSw: | -4.1981 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.489 |
InChI Key: | UEUAKCYNXDPCRC-UHFFFAOYSA-N |