ethyl 4-(4-benzylpiperidine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-benzylpiperidine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-(4-benzylpiperidine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | E966-1364 |
| Compound Name: | ethyl 4-(4-benzylpiperidine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C22 H30 N2 O4 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCC(CC1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6044 |
| logD: | 3.6044 |
| logSw: | -3.9336 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.21 |
| InChI Key: | XYAJQSBYOYVAGZ-UHFFFAOYSA-N |