ethyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-0132 |
| Compound Name: | ethyl 4-{4-[(4-bromo-3-methylphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 526.45 |
| Molecular Formula: | C22 H28 Br N3 O5 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(Nc1ccc(c(C)c1)[Br])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4557 |
| logD: | 3.4554 |
| logSw: | -3.7656 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.582 |
| InChI Key: | HEQPRORODSECRK-UHFFFAOYSA-N |