(E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
TL;DR: (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile (CAS 168476-38-8) is a chemical compound with molecular formula C18H16N2S and molecular weight 292.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-phenylethenyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile, 4-[(E)-2-phenylethenyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
| Molecular Formula | C18H16N2S |
|---|---|
| Molecular Weight | 292.10 g/mol |
| LogP | 4.66507 |
| Topological Polar Surface Area | 39.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.10342 |
| Heavy Atoms | 21 |
| Complexity | 779.3461 |
Chemical Identifiers
| CAS Number | 168476-38-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(C(=S)N2)C#N)/C=C/C3=CC=CC=C3 |
Product Overview
(E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile (CAS 168476-38-8), with molecular formula C18H16N2S and molecular weight 292.10 g/mol. IUPAC: 4-[(E)-2-phenylethenyl]-2-sulfanylidene-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Property Insights of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
The XLogP value of 4.66507 indicates that (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.58 Ų, (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile?
The CAS number of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile is 168476-38-8.
What is the molecular formula of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile?
The molecular formula of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile is C18H16N2S.
What is the molecular weight of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile?
The molecular weight of (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile is 292.10 g/mol.
Where can I buy (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile?
You can request a quote for (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-styryl-2-thioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.