5-{[(4-chlorophenyl)sulfanyl]methyl}-3-(3,4-dimethoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-{[(4-chlorophenyl)sulfanyl]methyl}-3-(3,4-dimethoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
5-{[(4-chlorophenyl)sulfanyl]methyl}-3-(3,4-dimethoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8019-3542 |
| Compound Name: | 5-{[(4-chlorophenyl)sulfanyl]methyl}-3-(3,4-dimethoxyphenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 441.93 |
| Molecular Formula: | C22 H20 Cl N3 O3 S |
| Smiles: | Cc1c(c2ccc(c(c2)OC)OC)c2NC(CSc3ccc(cc3)[Cl])=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.93 |
| logD: | 3.8125 |
| logSw: | -4.8392 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.797 |
| InChI Key: | YAOGAVUZVHDSIE-UHFFFAOYSA-N |