ethyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0101 |
| Compound Name: | ethyl 4-{4-[(3,4-dimethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C23 H31 N3 O5 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(Nc1ccc(C)c(C)c1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2686 |
| logD: | 3.2686 |
| logSw: | -3.3764 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.582 |
| InChI Key: | LVKCZVRTSNMFLS-UHFFFAOYSA-N |