3-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-7249 |
| Compound Name: | 3-(azepane-1-sulfonyl)-1-methyl-N-[(4-methylphenyl)methyl]-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 390.5 |
| Molecular Formula: | C19 H26 N4 O3 S |
| Smiles: | Cc1ccc(CNC(c2cn(C)nc2S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5236 |
| logD: | 2.5234 |
| logSw: | -2.9984 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.824 |
| InChI Key: | WOTAPWDKGMXNNG-UHFFFAOYSA-N |