N-(2H-1,3-benzodioxol-5-yl)-8-chloro[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-8-chloro[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
N-(2H-1,3-benzodioxol-5-yl)-8-chloro[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Compound characteristics
| Compound ID: | C850-0227 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-8-chloro[1,2,4]triazolo[4,3-a]quinoxalin-4-amine |
| Molecular Weight: | 339.74 |
| Molecular Formula: | C16 H10 Cl N5 O2 |
| Smiles: | C1Oc2ccc(cc2O1)Nc1c2nncn2c2cc(ccc2n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2754 |
| logD: | 3.264 |
| logSw: | -3.6798 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.194 |
| InChI Key: | RSQBMDNFSSHSFR-UHFFFAOYSA-N |