6-Methyl-2-propylsulfanylquinoline-3-carbonitrile
TL;DR: 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile (CAS 333328-80-6) is a chemical compound with molecular formula C14H14N2S and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-propylsulfanylquinoline-3-carbonitrile
Also Known As: 6-methyl-2-propylsulfanylquinoline-3-carbonitrile, BAS 02240363, 6-methyl-2-(propylsulfanyl)quinoline-3-carbonitrile, 6-Methyl-2-propylsulfanyl-quinoline-3-carbonitrile
| Molecular Formula | C14H14N2S |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 3.917 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.08777 |
| Heavy Atoms | 17 |
| Complexity | 584.5273 |
Chemical Identifiers
| CAS Number | 333328-80-6 |
|---|---|
| SMILES | CCCSC1=C(C=C2C=C(C=CC2=N1)C)C#N |
Product Overview
6-Methyl-2-propylsulfanylquinoline-3-carbonitrile (CAS 333328-80-6), with molecular formula C14H14N2S and molecular weight 242.09 g/mol. IUPAC: 6-methyl-2-propylsulfanylquinoline-3-carbonitrile.
Chemical Property Profile of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile
Property Insights of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile
The XLogP value of 3.917 indicates that 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile has 0 hydrogen bond donor(s) and 3 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 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile?
The CAS number of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile is 333328-80-6.
What is the molecular formula of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile?
The molecular formula of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile is C14H14N2S.
What is the molecular weight of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile?
The molecular weight of 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile is 242.09 g/mol.
Where can I buy 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile?
You can request a quote for 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methyl-2-propylsulfanylquinoline-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.