N-benzyl-2-(3,5-dimethylphenyl)-4-[(3-fluorophenyl)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)-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-2-(3,5-dimethylphenyl)-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-6072 |
| Compound Name: | N-benzyl-2-(3,5-dimethylphenyl)-4-[(3-fluorophenyl)methyl]-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C26 H23 F N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(c1)N1C(N(Cc2cccc(c2)F)C(C(C(NCc2ccccc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7886 |
| logD: | 4.7743 |
| logSw: | -4.5942 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.658 |
| InChI Key: | AOBCNWQQXWJMSO-UHFFFAOYSA-N |