N-benzyl-N-methyl-2-(3-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-N-methyl-2-(3-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-N-methyl-2-(3-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V026-0533 |
| Compound Name: | N-benzyl-N-methyl-2-(3-methylphenyl)-4-[(2-methylphenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C27 H26 N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccccc2C)C(C(C(N(C)Cc2ccccc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0968 |
| logD: | 5.0968 |
| logSw: | -4.9133 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.395 |
| InChI Key: | XSCPBVGCTGWIBK-UHFFFAOYSA-N |