ethyl 4-{4-[(4-ethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(4-ethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[(4-ethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0051 |
| Compound Name: | ethyl 4-{4-[(4-ethylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C23 H31 N3 O5 S |
| Smiles: | CCc1ccc(cc1)NC(C1CCN(CC1)S(c1c(C(=O)OCC)c(C)[nH]c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2118 |
| logD: | 3.2118 |
| logSw: | -3.3505 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.582 |
| InChI Key: | FFHUFUKNZGRZKR-UHFFFAOYSA-N |