N-(3-chloro-4-fluorophenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
N-(3-chloro-4-fluorophenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | D579-0002 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide |
| Molecular Weight: | 358.76 |
| Molecular Formula: | C17 H12 Cl F N4 O2 |
| Smiles: | C(C(Nc1ccc(c(c1)[Cl])F)=O)N1C(N=C(C=N1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2445 |
| logD: | 3.2384 |
| logSw: | -3.647 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.211 |
| InChI Key: | XTIIIXJMZAUDCP-UHFFFAOYSA-N |