N-benzyl-2-(4-methoxyphenyl)-N-methyl-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(4-methoxyphenyl)-N-methyl-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-2-(4-methoxyphenyl)-N-methyl-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V007-1339 |
| Compound Name: | N-benzyl-2-(4-methoxyphenyl)-N-methyl-3,5-dioxo-4-{[4-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 524.5 |
| Molecular Formula: | C27 H23 F3 N4 O4 |
| Smiles: | CN(Cc1ccccc1)C(C1C(N(Cc2ccc(cc2)C(F)(F)F)C(N(c2ccc(cc2)OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.83 |
| logD: | 4.83 |
| logSw: | -4.6044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.939 |
| InChI Key: | LWNSWKQXHLXUAF-UHFFFAOYSA-N |