N-(3-chloro-4-methoxyphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
N-(3-chloro-4-methoxyphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | D579-0028 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide |
| Molecular Weight: | 370.79 |
| Molecular Formula: | C18 H15 Cl N4 O3 |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N=C(C=N1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.025 |
| logD: | 3.0229 |
| logSw: | -3.5107 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.841 |
| InChI Key: | XPMYMVYUPKNTTG-UHFFFAOYSA-N |