N-benzyl-2-(3,5-dimethylphenyl)-N-methyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(3,5-dimethylphenyl)-N-methyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-2-(3,5-dimethylphenyl)-N-methyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V011-7931 |
| Compound Name: | N-benzyl-2-(3,5-dimethylphenyl)-N-methyl-4-[(4-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C28 H28 N4 O3 |
| Smiles: | Cc1ccc(CN2C(C(C(N(C)Cc3ccccc3)=O)=NN(C2=O)c2cc(C)cc(C)c2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4144 |
| logD: | 5.4144 |
| logSw: | -5.2664 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.395 |
| InChI Key: | LIGMGPKBJURULZ-UHFFFAOYSA-N |