N-[(4-methoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-[(4-methoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1561 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-1-methyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C20 H19 N3 O2 S |
| Smiles: | Cn1c2c3ccccc3SCc2c(C(NCc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.9433 |
| logD: | 2.9433 |
| logSw: | -3.6556 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.519 |
| InChI Key: | VWTVDGQOYTUFNN-UHFFFAOYSA-N |