3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-
TL;DR: 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- (CAS 120517-52-4) is a chemical compound with molecular formula C14H12N2S2 and molecular weight 272.0442 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-sulfanylidene-4-thiophen-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: Maybridge4_004637, 1H-indol-2-yl phenyl sulfide, BAS 00637715, 2-Mercapto-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile, 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-
Technical Specifications
| Molecular Formula | C14H12N2S2 |
| Molecular Weight | 272.0442 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 96.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.0442 Da |
| Heavy Atoms | 18 |
| Complexity | 507.0 |
| SMILES | C1CCC2=C(C1)C(=C(C(=S)N2)C#N)C3=CC=CS3 |
| InChIKey | YFPLWQQSRJQHQF-UHFFFAOYSA-N |
Chemical Property Profile of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-
Property Insights of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-. Following Lipinski's Rule of Five, 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-?
The CAS number of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- is 120517-52-4.
What is the molecular formula of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-?
The molecular formula of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- is C14H12N2S2.
What is the molecular weight of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-?
The molecular weight of 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- is 272.0442 g/mol.
Where can I buy 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-?
You can request a quote for 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo-?
Yes, CoreyChem provides custom synthesis services for 3-Quinolinecarbonitrile, 1,2,5,6,7,8-hexahydro-4-(2-thienyl)-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.