6-[(3-methoxyphenyl)methyl]-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
6-[(3-methoxyphenyl)methyl]-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-4(1H)-one
6-[(3-methoxyphenyl)methyl]-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | C200-2672 |
| Compound Name: | 6-[(3-methoxyphenyl)methyl]-2-sulfanylidene-2,3,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 303.38 |
| Molecular Formula: | C15 H17 N3 O2 S |
| Smiles: | COc1cccc(CN2CCC3=C(C2)C(NC(N3)=S)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.9433 |
| logD: | 0.7824 |
| logSw: | -2.7271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.092 |
| InChI Key: | ZZOSXTIXGSBQOL-UHFFFAOYSA-N |