2-amino-4-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8013-8478 |
| Compound Name: | 2-amino-4-[4-(methylsulfanyl)phenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 295.4 |
| Molecular Formula: | C17 H17 N3 S |
| Smiles: | CSc1ccc(cc1)c1c2CCCCc2nc(c1C#N)N |
| Stereo: | ACHIRAL |
| logP: | 4.2095 |
| logD: | 4.2067 |
| logSw: | -4.5637 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.757 |
| InChI Key: | OKUMPNLXKDAYCB-UHFFFAOYSA-N |