2-[5-(4-chlorophenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[5-(4-chlorophenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
2-[5-(4-chlorophenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
Compound ID: | D579-0391 |
Compound Name: | 2-[5-(4-chlorophenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]-N-(4-fluorophenyl)acetamide |
Molecular Weight: | 358.76 |
Molecular Formula: | C17 H12 Cl F N4 O2 |
Smiles: | C(C(Nc1ccc(cc1)F)=O)N1C(N=C(C=N1)c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.2432 |
logD: | 3.2421 |
logSw: | -3.8465 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.211 |
InChI Key: | NYHJQOQGOVYRDT-UHFFFAOYSA-N |