2-{5-[(4-chlorophenyl)methyl]-6-oxo-3-phenyl-1,2,4-triazin-1(6H)-yl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{5-[(4-chlorophenyl)methyl]-6-oxo-3-phenyl-1,2,4-triazin-1(6H)-yl}-N-(4-methylphenyl)acetamide
2-{5-[(4-chlorophenyl)methyl]-6-oxo-3-phenyl-1,2,4-triazin-1(6H)-yl}-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | G879-0086 |
| Compound Name: | 2-{5-[(4-chlorophenyl)methyl]-6-oxo-3-phenyl-1,2,4-triazin-1(6H)-yl}-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 444.92 |
| Molecular Formula: | C25 H21 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1)NC(CN1C(C(Cc2ccc(cc2)[Cl])=NC(c2ccccc2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9488 |
| logD: | 4.9488 |
| logSw: | -5.0752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.295 |
| InChI Key: | KJLLBJQLTGRCPE-UHFFFAOYSA-N |