N-(4-acetylphenyl)-5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
N-(4-acetylphenyl)-5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Compound characteristics
| Compound ID: | L152-0002 |
| Compound Name: | N-(4-acetylphenyl)-5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide |
| Molecular Weight: | 485.93 |
| Molecular Formula: | C26 H20 Cl N5 O3 |
| Smiles: | CC(c1ccc(cc1)NC(c1nc2C(N(Cc3ccc(cc3)[Cl])c3cc(C)ccc3n2n1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5202 |
| logD: | 4.5104 |
| logSw: | -4.6515 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.541 |
| InChI Key: | JJTRPTMNXSFXHN-UHFFFAOYSA-N |