2-(4-methoxyphenyl)-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
2-(4-methoxyphenyl)-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | S020-2694 |
| Compound Name: | 2-(4-methoxyphenyl)-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | COc1ccc(cc1)C1NC2CN(CCC=2C(N=1)=O)C(CSc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7715 |
| logD: | 0.9215 |
| logSw: | -3.32 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.268 |
| InChI Key: | WDUDCPMLNYKMDP-UHFFFAOYSA-N |