1-(2,3-dihydro-1H-indol-1-yl)-2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | G788-0004 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{[3-(3,4-dimethoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | Cc1cc(n2c(c(cn2)c2ccc(c(c2)OC)OC)n1)SCC(N1CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0352 |
| logD: | 4.03 |
| logSw: | -4.0285 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.607 |
| InChI Key: | NQQQRSNCZZCCDE-UHFFFAOYSA-N |