ethyl 5-({N-benzyl[2-(trifluoromethyl)phenyl]carbamamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({N-benzyl[2-(trifluoromethyl)phenyl]carbamamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-({N-benzyl[2-(trifluoromethyl)phenyl]carbamamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F346-0105 |
| Compound Name: | ethyl 5-({N-benzyl[2-(trifluoromethyl)phenyl]carbamamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 473.49 |
| Molecular Formula: | C25 H26 F3 N3 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccccc2)C(Nc2ccccc2C(F)(F)F)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.271 |
| logD: | 5.271 |
| logSw: | -5.2302 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.531 |
| InChI Key: | SWXPJTKQSGHXPB-UHFFFAOYSA-N |