2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 4981-0541 |
| Compound Name: | 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 485.6 |
| Molecular Formula: | C21 H19 N5 O3 S3 |
| Smiles: | C1CCc2c(C1)cc(C#N)c(n2)SCC(Nc1ccc(cc1)S(Nc1nccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5989 |
| logD: | 3.1891 |
| logSw: | -3.8978 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.469 |
| InChI Key: | PXWCWQFTVWPXNV-UHFFFAOYSA-N |