[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | G636-2535 |
| Compound Name: | [4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrol-2-yl][4-(2-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C22 H29 F N4 O3 S |
| Smiles: | Cn1cc(cc1C(N1CCN(CC1)c1ccccc1F)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8771 |
| logD: | 2.8771 |
| logSw: | -3.4504 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.198 |
| InChI Key: | PKXPXQMGZWAWAJ-UHFFFAOYSA-N |