N-(2-methoxyethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-(2-methoxyethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V002-3131 |
| Compound Name: | N-(2-methoxyethyl)-4-[(3-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 462.43 |
| Molecular Formula: | C22 H21 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | Cc1cccc(CN2C(C(C(NCCOC)=O)=NN(C2=O)c2cccc(c2)C(F)(F)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6511 |
| logD: | 3.6506 |
| logSw: | -3.9166 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.114 |
| InChI Key: | HTUKKGRIMOEIEL-UHFFFAOYSA-N |