2-{[(3-chlorophenyl)methyl]sulfanyl}-6-[(2-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-6-[(2-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-6-[(2-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0215 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-6-[(2-methoxyphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 427.95 |
| Molecular Formula: | C22 H22 Cl N3 O2 S |
| Smiles: | COc1ccccc1CN1CCC2=C(C1)C(NC(=N2)SCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8968 |
| logD: | 3.4953 |
| logSw: | -4.3021 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.576 |
| InChI Key: | KAVWUANBDHKOGS-UHFFFAOYSA-N |