4-{[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-(butan-2-yl)benzamide
Chemical Structure Depiction of
4-{[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-(butan-2-yl)benzamide
4-{[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-(butan-2-yl)benzamide
Compound characteristics
| Compound ID: | M358-1132 |
| Compound Name: | 4-{[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methyl}-N-(butan-2-yl)benzamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C23 H34 N4 O3 S |
| Smiles: | CCC(C)NC(c1ccc(Cn2c(C)c(c(C)n2)S(N2CCCCCC2)(=O)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3828 |
| logD: | 2.3828 |
| logSw: | -2.7907 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.688 |
| InChI Key: | CHXBOQUZFQZKTQ-KRWDZBQOSA-N |