N-cyclopropyl-4-[(4-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-cyclopropyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-cyclopropyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V020-9354 |
| Compound Name: | N-cyclopropyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 444.41 |
| Molecular Formula: | C22 H19 F3 N4 O3 |
| Smiles: | Cc1ccc(CN2C(C(C(NC3CC3)=O)=NN(C2=O)c2cccc(c2)C(F)(F)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.067 |
| logD: | 4.0637 |
| logSw: | -4.0871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.715 |
| InChI Key: | VGCPDJXXKQKUOD-UHFFFAOYSA-N |