8-chloro-N-(3,4-dimethylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
8-chloro-N-(3,4-dimethylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
8-chloro-N-(3,4-dimethylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1086 |
| Compound Name: | 8-chloro-N-(3,4-dimethylphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 383.9 |
| Molecular Formula: | C20 H18 Cl N3 O S |
| Smiles: | Cc1ccc(cc1C)NC(c1c2CSc3ccc(cc3c2n(C)n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2158 |
| logD: | 5.2158 |
| logSw: | -5.4553 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.653 |
| InChI Key: | LJXRXUHIFCVCER-UHFFFAOYSA-N |