ethyl 4-[N-(benzenesulfonyl)-N-(3-methylbutyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[N-(benzenesulfonyl)-N-(3-methylbutyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[N-(benzenesulfonyl)-N-(3-methylbutyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-7280 |
| Compound Name: | ethyl 4-[N-(benzenesulfonyl)-N-(3-methylbutyl)glycyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 448.58 |
| Molecular Formula: | C23 H32 N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C(CN(CCC(C)C)S(c2ccccc2)(=O)=O)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8794 |
| logD: | 3.8794 |
| logSw: | -4.1117 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.401 |
| InChI Key: | LGXRWDOYPZGFOU-UHFFFAOYSA-N |