ethyl 1,3,5-trimethyl-4-{N-(3-methylbutyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1,3,5-trimethyl-4-{N-(3-methylbutyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1H-pyrrole-2-carboxylate
ethyl 1,3,5-trimethyl-4-{N-(3-methylbutyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V026-2390 |
| Compound Name: | ethyl 1,3,5-trimethyl-4-{N-(3-methylbutyl)-N-[4-(trifluoromethyl)benzoyl]glycyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 480.53 |
| Molecular Formula: | C25 H31 F3 N2 O4 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(CN(CCC(C)C)C(c2ccc(cc2)C(F)(F)F)=O)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.646 |
| logD: | 4.646 |
| logSw: | -4.4733 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.237 |
| InChI Key: | QIIVCRDSOKDEGQ-UHFFFAOYSA-N |