N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide
Compound characteristics
| Compound ID: | L757-0066 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-3-[4-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxalin-1-yl]propanamide |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C26 H30 N6 O3 |
| Smiles: | COc1ccc(CNC(CCc2nnc3c(nc4ccccc4n23)N2CCCCC2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.9775 |
| logD: | 2.9722 |
| logSw: | -3.1938 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.743 |
| InChI Key: | HJVQSSXKTNYXDO-UHFFFAOYSA-N |