2,2'-[methylenebis(sulfanediyl)]bis(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile)
Chemical Structure Depiction of
2,2'-[methylenebis(sulfanediyl)]bis(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile)
2,2'-[methylenebis(sulfanediyl)]bis(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile)
Compound characteristics
| Compound ID: | G856-1466 |
| Compound Name: | 2,2'-[methylenebis(sulfanediyl)]bis(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile) |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | CC1(C)CC(c2cc(C#N)c(nc2C1)SCSc1c(C#N)cc2C(CC(C)(C)Cc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8144 |
| logD: | 4.8144 |
| logSw: | -4.6384 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.912 |
| InChI Key: | FQXCMAJLNJRJOU-UHFFFAOYSA-N |