2-[3-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-1-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[3-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-1-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
2-[3-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-1-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | M955-0836 |
| Compound Name: | 2-[3-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-1-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}acetamide |
| Molecular Weight: | 432.44 |
| Molecular Formula: | C22 H23 F3 N4 O2 |
| Smiles: | Cc1cc(c(C)n1CC(NCc1cccc(c1)C(F)(F)F)=O)c1nnc(C2CCC2)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.5038 |
| logD: | 3.5038 |
| logSw: | -3.7527 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.399 |
| InChI Key: | KCROHASJRNAMBC-UHFFFAOYSA-N |