7-(2H-1,3-benzodioxol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
7-(2H-1,3-benzodioxol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
7-(2H-1,3-benzodioxol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L390-2688 |
| Compound Name: | 7-(2H-1,3-benzodioxol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C22 H18 N4 O3 S |
| Smiles: | CSc1ccc(CNC(c2cnn3c(ccnc23)c2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0148 |
| logD: | 4.0148 |
| logSw: | -4.1665 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.129 |
| InChI Key: | YUNFHRPDXOTQQY-UHFFFAOYSA-N |