N-(2-ethylphenyl)-N-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-N-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(2-ethylphenyl)-N-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E213-0102 |
| Compound Name: | N-(2-ethylphenyl)-N-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 349.45 |
| Molecular Formula: | C20 H19 N3 O S |
| Smiles: | CCc1ccccc1N(C)C(c1c2CSc3ccccc3c2[nH]n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.148 |
| logD: | 4.148 |
| logSw: | -4.2109 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.348 |
| InChI Key: | NBXWEKVGQAFUBJ-UHFFFAOYSA-N |