N-(4-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
N-(4-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | D579-0027 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-2-(3-oxo-5-phenyl-1,2,4-triazin-2(3H)-yl)acetamide |
| Molecular Weight: | 354.79 |
| Molecular Formula: | C18 H15 Cl N4 O2 |
| Smiles: | Cc1cc(ccc1NC(CN1C(N=C(C=N1)c1ccccc1)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.375 |
| logD: | 3.3731 |
| logSw: | -3.696 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.513 |
| InChI Key: | KWLONIIDCIPGQC-UHFFFAOYSA-N |