N-benzyl-4-[(2-chlorophenyl)methyl]-N-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(2-chlorophenyl)methyl]-N-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-4-[(2-chlorophenyl)methyl]-N-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V030-4874 |
| Compound Name: | N-benzyl-4-[(2-chlorophenyl)methyl]-N-methyl-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 460.92 |
| Molecular Formula: | C25 H21 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CN(Cc1ccccc1)C(C1C(N(Cc2ccccc2[Cl])C(N(c2ccccc2)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3373 |
| logD: | 4.3373 |
| logSw: | -4.3597 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.395 |
| InChI Key: | VRQSGXMFYREIFM-UHFFFAOYSA-N |