[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrol-2-yl][4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrol-2-yl][4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrol-2-yl][4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | F379-1654 |
| Compound Name: | [4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrol-2-yl][4-(2,3-dimethylphenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 472.65 |
| Molecular Formula: | C25 H36 N4 O3 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(c1c(C)c(c(C)[nH]1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.191 |
| logD: | 4.191 |
| logSw: | -4.1049 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.87 |
| InChI Key: | XZQLUFBODKMPJT-UHFFFAOYSA-N |