N-(4-acetylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(4-acetylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1621 |
| Compound Name: | N-(4-acetylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | CC(c1ccc(cc1)NC(c1c2CSc3ccccc3c2n(C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9117 |
| logD: | 2.9095 |
| logSw: | -3.664 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.479 |
| InChI Key: | HTYUDAFQDLNBRK-UHFFFAOYSA-N |