4-[(2-chlorophenyl)methyl]-2-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-2-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-2-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V030-2720 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-2-(3,4-dimethylphenyl)-N-(4-fluorophenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 478.91 |
| Molecular Formula: | C25 H20 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)N1C(N(Cc2ccccc2[Cl])C(C(C(Nc2ccc(cc2)F)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6776 |
| logD: | 4.8072 |
| logSw: | -5.8594 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.336 |
| InChI Key: | UKOSLGBPIMINHZ-UHFFFAOYSA-N |