6-[(4-methoxyphenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(4-methoxyphenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
6-[(4-methoxyphenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0187 |
| Compound Name: | 6-[(4-methoxyphenyl)methyl]-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C23 H25 N3 O3 S |
| Smiles: | COc1ccc(CN2CCC3=C(C2)C(NC(=N3)SCc2cccc(c2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.173 |
| logD: | 2.7716 |
| logSw: | -3.4769 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.033 |
| InChI Key: | VWVWGVSPMOGCKO-UHFFFAOYSA-N |