ethyl 2,5-dimethyl-4-[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-4-[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-4-[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G070-0108 |
| Compound Name: | ethyl 2,5-dimethyl-4-[4-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)piperidine-1-sulfonyl]-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C26 H33 N3 O5 S |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCC(CC1)C(N1CCC(=CC1)c1ccccc1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3994 |
| logD: | 3.3994 |
| logSw: | -3.5768 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.868 |
| InChI Key: | LHUTXWKYOFKXBZ-UHFFFAOYSA-N |