ethyl 4-{N-ethyl-N-[4-(trifluoromethyl)benzoyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-ethyl-N-[4-(trifluoromethyl)benzoyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-ethyl-N-[4-(trifluoromethyl)benzoyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V007-3745 |
| Compound Name: | ethyl 4-{N-ethyl-N-[4-(trifluoromethyl)benzoyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 424.42 |
| Molecular Formula: | C21 H23 F3 N2 O4 |
| Smiles: | CCN(CC(c1c(C)c(C(=O)OCC)[nH]c1C)=O)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5397 |
| logD: | 3.5397 |
| logSw: | -3.7759 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.156 |
| InChI Key: | QHCWWDPOWWYTTI-UHFFFAOYSA-N |