4-(4-methylphenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
4-(4-methylphenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
4-(4-methylphenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | 8015-3387 |
| Compound Name: | 4-(4-methylphenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 413.56 |
| Molecular Formula: | C21 H23 N3 O2 S2 |
| Smiles: | CCCSc1nnc(N2C3CCCC(C=3C(CC2=O)c2ccc(C)cc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9918 |
| logD: | 3.9918 |
| logSw: | -3.9682 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.266 |
| InChI Key: | VHHAQXYECZAEBZ-OAHLLOKOSA-N |