ethyl 1,3,5-trimethyl-4-[N-(3-methylbutyl)-N-(thiophene-2-carbonyl)glycyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1,3,5-trimethyl-4-[N-(3-methylbutyl)-N-(thiophene-2-carbonyl)glycyl]-1H-pyrrole-2-carboxylate
ethyl 1,3,5-trimethyl-4-[N-(3-methylbutyl)-N-(thiophene-2-carbonyl)glycyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V026-2413 |
| Compound Name: | ethyl 1,3,5-trimethyl-4-[N-(3-methylbutyl)-N-(thiophene-2-carbonyl)glycyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C22 H30 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(CN(CCC(C)C)C(c2cccs2)=O)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9097 |
| logD: | 3.9097 |
| logSw: | -4.0725 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.255 |
| InChI Key: | JAMBJDBUSDTEMP-UHFFFAOYSA-N |