methyl 5-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
methyl 5-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F602-1031 |
| Compound Name: | methyl 5-{3-[4-(3-chlorophenyl)piperazine-1-carbonyl]piperidine-1-carbonyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 487 |
| Molecular Formula: | C25 H31 Cl N4 O4 |
| Smiles: | Cc1c(C(=O)OC)c(C)[nH]c1C(N1CCCC(C1)C(N1CCN(CC1)c1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.016 |
| logD: | 3.016 |
| logSw: | -3.7982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.884 |
| InChI Key: | XKJCJLBFIUBIPR-SFHVURJKSA-N |