{1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidin-4-yl}[4-(4-fluorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidin-4-yl}[4-(4-fluorophenyl)piperazin-1-yl]methanone
{1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidin-4-yl}[4-(4-fluorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | F533-0150 |
| Compound Name: | {1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidin-4-yl}[4-(4-fluorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 545.68 |
| Molecular Formula: | C27 H36 F N5 O4 S |
| Smiles: | Cc1c(C(N2CCCC2)=O)c(c(C)[nH]1)S(N1CCC(CC1)C(N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4331 |
| logD: | 2.4331 |
| logSw: | -2.8183 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.66 |
| InChI Key: | OMONJTFNISUCRH-UHFFFAOYSA-N |