N-(5-chloro-2-cyanophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-cyanophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
N-(5-chloro-2-cyanophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | G842-0746 |
| Compound Name: | N-(5-chloro-2-cyanophenyl)-2-oxo-1-{[3-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide |
| Molecular Weight: | 431.8 |
| Molecular Formula: | C21 H13 Cl F3 N3 O2 |
| Smiles: | C(c1cccc(c1)C(F)(F)F)N1C=CC=C(C(Nc2cc(ccc2C#N)[Cl])=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.712 |
| logD: | 0.2972 |
| logSw: | -4.5173 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.402 |
| InChI Key: | ZMPLJVAOQAOECL-UHFFFAOYSA-N |