1-(4-{4-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | F379-0904 |
| Compound Name: | 1-(4-{4-[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 486.63 |
| Molecular Formula: | C25 H34 N4 O4 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)c(C(N2CCN(CC2)c2ccc(cc2)C(C)=O)=O)[nH]c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7092 |
| logD: | 2.7092 |
| logSw: | -3.0687 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.666 |
| InChI Key: | QXYRKXDXLUMWPD-UHFFFAOYSA-N |