N-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V010-6080 |
| Compound Name: | N-(4-fluorophenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 502.4 |
| Molecular Formula: | C24 H15 F5 N4 O3 |
| Smiles: | C(c1ccc(cc1)F)N1C(C(C(Nc2ccc(cc2)F)=O)=NN(C1=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9468 |
| logD: | 4.0765 |
| logSw: | -4.8608 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.336 |
| InChI Key: | NJSWZSLTNYUOFD-UHFFFAOYSA-N |