butyl 4-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
butyl 4-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate
Compound characteristics
| Compound ID: | E208-0055 |
| Compound Name: | butyl 4-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzoate |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C21 H21 N5 O2 |
| Smiles: | CCCCOC(c1ccc(cc1)Nc1c2nnc(C)n2c2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4375 |
| logD: | 4.4286 |
| logSw: | -4.2497 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.297 |
| InChI Key: | PXVAJKVWRGPPGA-UHFFFAOYSA-N |