2-phenyl-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Chemical Structure Depiction of
2-phenyl-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
2-phenyl-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one
Compound characteristics
| Compound ID: | S022-1019 |
| Compound Name: | 2-phenyl-7-[(phenylsulfanyl)acetyl]-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one |
| Molecular Weight: | 416.5 |
| Molecular Formula: | C23 H20 N4 O2 S |
| Smiles: | C1CN(CC2=C1N=C1C=C(c3ccccc3)NN1C2=O)C(CSc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6479 |
| logD: | 2.6477 |
| logSw: | -2.9075 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.266 |
| InChI Key: | JAKMSJQONZKGKH-UHFFFAOYSA-N |