2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-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-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide
2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide
Compound characteristics
| Compound ID: | 6850-0195 |
| Compound Name: | 2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide |
| Molecular Weight: | 539.68 |
| Molecular Formula: | C29 H25 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)c1nc(NC(CSc2c(C#N)c(c3ccccc3)c3C(CC(C)(C)Cc3n2)=O)=O)ns1 |
| Stereo: | ACHIRAL |
| logP: | 6.4678 |
| logD: | 6.4678 |
| logSw: | -5.8802 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.998 |
| InChI Key: | LWIJLVTXKQLXRV-UHFFFAOYSA-N |