8-chloro-N-(4-ethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
8-chloro-N-(4-ethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
8-chloro-N-(4-ethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0851 |
| Compound Name: | 8-chloro-N-(4-ethoxyphenyl)-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 399.9 |
| Molecular Formula: | C20 H18 Cl N3 O2 S |
| Smiles: | CCOc1ccc(cc1)NC(c1c2CSc3ccc(cc3c2n(C)n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5974 |
| logD: | 4.5973 |
| logSw: | -4.6648 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.776 |
| InChI Key: | RXFIOCDRQNPAIU-UHFFFAOYSA-N |