3-(azepane-1-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-7252 |
| Compound Name: | 3-(azepane-1-sulfonyl)-N-[(2-methoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 406.5 |
| Molecular Formula: | C19 H26 N4 O4 S |
| Smiles: | Cn1cc(C(NCc2ccccc2OC)=O)c(n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3216 |
| logD: | 2.3213 |
| logSw: | -2.8098 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.455 |
| InChI Key: | DBAXRVDNZBBFBC-UHFFFAOYSA-N |