[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | G680-0191 |
| Compound Name: | [4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C21 H29 N3 O6 S |
| Smiles: | Cc1c(c(C)n(C(c2cc(c(c(c2)OC)OC)OC)=O)n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8585 |
| logD: | 1.8585 |
| logSw: | -2.2635 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.872 |
| InChI Key: | VNESDPOXBLJLIS-UHFFFAOYSA-N |