2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
Chemical Structure Depiction of
2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide
Compound characteristics
| Compound ID: | 6574-0296 |
| Compound Name: | 2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3-phenyl-1,2,4-thiadiazol-5-yl)acetamide |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C28 H23 N5 O2 S2 |
| Smiles: | CC1(C)CC(c2c(c3ccccc3)c(C#N)c(nc2C1)SCC(Nc1nc(c2ccccc2)ns1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0116 |
| logD: | 6.0114 |
| logSw: | -5.662 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.905 |
| InChI Key: | IKDDFOAVYRPQTF-UHFFFAOYSA-N |