N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | F989-0533 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4-yl]sulfanyl}acetamide |
Molecular Weight: | 435.5 |
Molecular Formula: | C22 H21 N5 O3 S |
Smiles: | CC(C)c1nnc2c(nc3ccccc3n12)SCC(Nc1ccc2c(c1)OCCO2)=O |
Stereo: | ACHIRAL |
logP: | 2.9938 |
logD: | 2.9938 |
logSw: | -3.3531 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.753 |
InChI Key: | SZCZWOFRCZAEOP-UHFFFAOYSA-N |