3-[3-(3-methylphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[3-(3-methylphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
3-[3-(3-methylphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | V006-4886 |
| Compound Name: | 3-[3-(3-methylphenyl)-5-oxo-2,5-dihydro-1,2,4-triazin-6-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide |
| Molecular Weight: | 416.4 |
| Molecular Formula: | C21 H19 F3 N4 O2 |
| Smiles: | Cc1cccc(c1)C1NN=C(CCC(NCc2cccc(c2)C(F)(F)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.009 |
| logD: | 3.009 |
| logSw: | -3.2661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.78 |
| InChI Key: | RDMMOYBQVOGEMA-UHFFFAOYSA-N |