8-chloro-N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
8-chloro-N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
8-chloro-N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1169 |
| Compound Name: | 8-chloro-N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 429.92 |
| Molecular Formula: | C21 H20 Cl N3 O3 S |
| Smiles: | Cn1c2c3cc(ccc3SCc2c(C(NCc2ccc(cc2OC)OC)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0393 |
| logD: | 4.0393 |
| logSw: | -4.6044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.149 |
| InChI Key: | JUTAMEAUDHYCNP-UHFFFAOYSA-N |