4-[(4-fluorophenyl)methyl]-3,5-dioxo-N,2-diphenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-3,5-dioxo-N,2-diphenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-3,5-dioxo-N,2-diphenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V001-3840 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-3,5-dioxo-N,2-diphenyl-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 416.41 |
| Molecular Formula: | C23 H17 F N4 O3 |
| Smiles: | C(c1ccc(cc1)F)N1C(C(C(Nc2ccccc2)=O)=NN(C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7431 |
| logD: | 3.7007 |
| logSw: | -4.1082 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.336 |
| InChI Key: | IVTUWIDMGLSSEG-UHFFFAOYSA-N |