6-methyl-4-[3-(methylsulfanyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-methyl-4-[3-(methylsulfanyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
6-methyl-4-[3-(methylsulfanyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F360-0136 |
| Compound Name: | 6-methyl-4-[3-(methylsulfanyl)anilino]quinoline-3-carbonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 341.86 |
| Molecular Formula: | C18 H15 N3 S |
| Salt: | HCl |
| Smiles: | Cc1ccc2c(c1)c(c(C#N)cn2)Nc1cccc(c1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.3823 |
| logD: | 4.3821 |
| logSw: | -4.318 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.664 |
| InChI Key: | CLIJUNIEDWOHDJ-UHFFFAOYSA-N |