N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
Compound characteristics
Compound ID: | L757-0067 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide |
Molecular Weight: | 458.52 |
Molecular Formula: | C25 H26 N6 O3 |
Smiles: | C1CCN(CC1)c1c2nnc(CCC(NCc3ccc4c(c3)OCO4)=O)n2c2ccccc2n1 |
Stereo: | ACHIRAL |
logP: | 3.2756 |
logD: | 3.2704 |
logSw: | -3.3319 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.597 |
InChI Key: | DOBUJJYJEMQELO-UHFFFAOYSA-N |