1,8-dimethyl-N-(3,4,5-trimethoxyphenyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1,8-dimethyl-N-(3,4,5-trimethoxyphenyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
1,8-dimethyl-N-(3,4,5-trimethoxyphenyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0410 |
| Compound Name: | 1,8-dimethyl-N-(3,4,5-trimethoxyphenyl)-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | Cc1ccc2c(c1)c1c(CS2)c(C(Nc2cc(c(c(c2)OC)OC)OC)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 3.3346 |
| logD: | 3.3313 |
| logSw: | -3.6957 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.631 |
| InChI Key: | QZAJXCOXHOVOCH-UHFFFAOYSA-N |