2-(3-methylphenyl)-3,5-dioxo-N-phenyl-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3-methylphenyl)-3,5-dioxo-N-phenyl-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3-methylphenyl)-3,5-dioxo-N-phenyl-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V002-0381 |
| Compound Name: | 2-(3-methylphenyl)-3,5-dioxo-N-phenyl-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 480.45 |
| Molecular Formula: | C25 H19 F3 N4 O3 |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccc(cc2)C(F)(F)F)C(C(C(Nc2ccccc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2115 |
| logD: | 5.1691 |
| logSw: | -5.011 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.336 |
| InChI Key: | HNELHANJHNGPNH-UHFFFAOYSA-N |