N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 6574-0115 |
| Compound Name: | N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 560.1 |
| Molecular Formula: | C28 H22 Cl N5 O2 S2 |
| Smiles: | CC1(C)CC(c2c(c3ccccc3)c(C#N)c(nc2C1)SCC(Nc1nc(c2ccc(cc2)[Cl])sn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6392 |
| logD: | 6.6391 |
| logSw: | -6.3188 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.998 |
| InChI Key: | ZRJXZUUOGGVCNT-UHFFFAOYSA-N |