2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | G788-0179 |
| Compound Name: | 2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 494.63 |
| Molecular Formula: | C25 H26 N4 O3 S2 |
| Smiles: | Cc1cc(n2c(c(cn2)c2ccc(c(c2)OC)OC)n1)SCC(NCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3367 |
| logD: | 4.3316 |
| logSw: | -4.1577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.656 |
| InChI Key: | ORTHURYNQGBZPF-UHFFFAOYSA-N |