ethyl 4-{4-[(3,4-dimethoxyphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(3,4-dimethoxyphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{4-[(3,4-dimethoxyphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | G070-0006 |
Compound Name: | ethyl 4-{4-[(3,4-dimethoxyphenyl)carbamoyl]piperidine-1-sulfonyl}-2,5-dimethyl-1H-pyrrole-3-carboxylate |
Molecular Weight: | 493.58 |
Molecular Formula: | C23 H31 N3 O7 S |
Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(Nc1ccc(c(c1)OC)OC)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.8161 |
logD: | 1.8159 |
logSw: | -2.6994 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 101.843 |
InChI Key: | XRJPOCJSLBPDJA-UHFFFAOYSA-N |