5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-N-(2,4,6-trimethylphenyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Chemical Structure Depiction of
5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-N-(2,4,6-trimethylphenyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-N-(2,4,6-trimethylphenyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide
Compound characteristics
| Compound ID: | L152-0053 |
| Compound Name: | 5-[(4-chlorophenyl)methyl]-7-methyl-4-oxo-N-(2,4,6-trimethylphenyl)-4,5-dihydro[1,2,4]triazolo[1,5-a]quinoxaline-2-carboxamide |
| Molecular Weight: | 485.97 |
| Molecular Formula: | C27 H24 Cl N5 O2 |
| Smiles: | Cc1ccc2c(c1)N(Cc1ccc(cc1)[Cl])C(c1nc(C(Nc3c(C)cc(C)cc3C)=O)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3539 |
| logD: | 5.3536 |
| logSw: | -5.7848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.319 |
| InChI Key: | VHDARSQKDMOENA-UHFFFAOYSA-N |