[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | G636-2487 |
| Compound Name: | [4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 498.57 |
| Molecular Formula: | C23 H29 F3 N4 O3 S |
| Smiles: | Cn1cc(cc1C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4993 |
| logD: | 3.4993 |
| logSw: | -3.7928 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.499 |
| InChI Key: | KRASUKWFIQOZKV-UHFFFAOYSA-N |