phenyl[4-(3,4,5-trimethoxyanilino)[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methanone
Chemical Structure Depiction of
phenyl[4-(3,4,5-trimethoxyanilino)[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methanone
phenyl[4-(3,4,5-trimethoxyanilino)[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methanone
Compound characteristics
| Compound ID: | C301-2314 |
| Compound Name: | phenyl[4-(3,4,5-trimethoxyanilino)[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]methanone |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C25 H21 N5 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)Nc1c2nncn2c2cc(ccc2n1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4535 |
| logD: | 3.4535 |
| logSw: | -3.9011 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.523 |
| InChI Key: | KEJWFVVORQCJHX-UHFFFAOYSA-N |