N-(5-chloro-2-methoxyphenyl)-N,1-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-N,1-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(5-chloro-2-methoxyphenyl)-N,1-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1539 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-N,1-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 399.9 |
| Molecular Formula: | C20 H18 Cl N3 O2 S |
| Smiles: | CN(C(c1c2CSc3ccccc3c2n(C)n1)=O)c1cc(ccc1OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5383 |
| logD: | 3.5383 |
| logSw: | -3.9777 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.26 |
| InChI Key: | XDZIGXCVZCXKDS-UHFFFAOYSA-N |