N-(3,5-dimethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(3,5-dimethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1328 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | Cn1c2c3ccccc3SCc2c(C(Nc2cc(cc(c2)OC)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5087 |
| logD: | 3.5071 |
| logSw: | -3.9571 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.74 |
| InChI Key: | AKGMQAOFOWFHBT-UHFFFAOYSA-N |