N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0204 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C21 H21 N5 O3 S |
| Smiles: | Cc1nnc2c(nc3ccccc3n12)SCC(NCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1208 |
| logD: | 2.1208 |
| logSw: | -2.7104 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.289 |
| InChI Key: | PSUCZEKYXDFQQI-UHFFFAOYSA-N |