1-(4-{4-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F379-0118 |
| Compound Name: | 1-(4-{4-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C23 H30 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1c(C)c(c(C)[nH]1)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9046 |
| logD: | 1.9046 |
| logSw: | -2.6033 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.032 |
| InChI Key: | HQKQOHXFPBOUSW-UHFFFAOYSA-N |