N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0085 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 393.42 |
| Molecular Formula: | C19 H15 N5 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CSc1c2nncn2c2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3086 |
| logD: | 2.3086 |
| logSw: | -2.8096 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.973 |
| InChI Key: | WQWOIERRTVBXSQ-UHFFFAOYSA-N |