2-(4-chlorophenyl)-N-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-N-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(4-chlorophenyl)-N-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
Compound ID: | G674-0389 |
Compound Name: | 2-(4-chlorophenyl)-N-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
Molecular Weight: | 374.76 |
Molecular Formula: | C17 H12 Cl F N4 O3 |
Smiles: | CN1C(C(C(Nc2ccc(cc2)F)=O)=NN(C1=O)c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.1595 |
logD: | 2.0587 |
logSw: | -3.7103 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.373 |
InChI Key: | OKERGSQYBNXQCK-UHFFFAOYSA-N |