N-(3-chloro-4-fluorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | D579-0626 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]acetamide |
| Molecular Weight: | 388.78 |
| Molecular Formula: | C18 H14 Cl F N4 O3 |
| Smiles: | COc1ccc(cc1)C1C=NN(CC(Nc2ccc(c(c2)[Cl])F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3319 |
| logD: | 3.3263 |
| logSw: | -3.7349 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.755 |
| InChI Key: | SSUYIMNKMAHQGM-UHFFFAOYSA-N |