N-(3,4-dimethylphenyl)-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-(3,4-dimethylphenyl)-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0733 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C25 H21 N5 O S |
| Smiles: | Cc1ccc(cc1C)NC(CSc1c2nnc(c3ccccc3)n2c2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7433 |
| logD: | 5.7433 |
| logSw: | -5.396 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.658 |
| InChI Key: | JDGUFICIQDNDDO-UHFFFAOYSA-N |