1-(4-{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | G636-2476 |
| Compound Name: | 1-(4-{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C24 H32 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1cc(cn1C)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3623 |
| logD: | 2.3623 |
| logSw: | -2.6491 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.326 |
| InChI Key: | SIGLWGQLKFSLFT-UHFFFAOYSA-N |