N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1695 |
| Compound Name: | N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | CCOc1ccc(CCNC(c2c3CSc4ccccc4c3n(C)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2634 |
| logD: | 3.2634 |
| logSw: | -3.7632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.94 |
| InChI Key: | DLKJJXBFHYBBFB-UHFFFAOYSA-N |