4-[(2-chlorophenyl)methyl]-N-(3-fluorophenyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(2-chlorophenyl)methyl]-N-(3-fluorophenyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(2-chlorophenyl)methyl]-N-(3-fluorophenyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V008-2819 |
| Compound Name: | 4-[(2-chlorophenyl)methyl]-N-(3-fluorophenyl)-3,5-dioxo-2-phenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 450.86 |
| Molecular Formula: | C23 H16 Cl F N4 O3 |
| Smiles: | C(c1ccccc1[Cl])N1C(C(C(Nc2cccc(c2)F)=O)=NN(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.543 |
| logD: | 3.6009 |
| logSw: | -4.5692 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.336 |
| InChI Key: | AQTXEZWFCCRPPN-UHFFFAOYSA-N |