N-(2-methylphenyl)quinoline-2-carbothioamide
TL;DR: N-(2-methylphenyl)quinoline-2-carbothioamide (CAS 431892-38-5) is a chemical compound with molecular formula C17H14N2S and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)quinoline-2-carbothioamide
Also Known As: N-(o-tolyl)quinoline-2-carbothioamide, N-(2-methylphenyl)quinoline-2-carbothioamide, o-tolyl-2-quinolinecarbothioamide
| Molecular Formula | C17H14N2S |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 4.33082 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.08777 |
| Heavy Atoms | 20 |
| Complexity | 780.5518 |
Chemical Identifiers
| CAS Number | 431892-38-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=S)C2=NC3=CC=CC=C3C=C2 |
Product Overview
N-(2-methylphenyl)quinoline-2-carbothioamide (CAS 431892-38-5), with molecular formula C17H14N2S and molecular weight 278.09 g/mol. IUPAC: N-(2-methylphenyl)quinoline-2-carbothioamide.
Chemical Property Profile of N-(2-methylphenyl)quinoline-2-carbothioamide
Property Insights of N-(2-methylphenyl)quinoline-2-carbothioamide
The XLogP value of 4.33082 indicates that N-(2-methylphenyl)quinoline-2-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, N-(2-methylphenyl)quinoline-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-methylphenyl)quinoline-2-carbothioamide 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 N-(2-methylphenyl)quinoline-2-carbothioamide?
The CAS number of N-(2-methylphenyl)quinoline-2-carbothioamide is 431892-38-5.
What is the molecular formula of N-(2-methylphenyl)quinoline-2-carbothioamide?
The molecular formula of N-(2-methylphenyl)quinoline-2-carbothioamide is C17H14N2S.
What is the molecular weight of N-(2-methylphenyl)quinoline-2-carbothioamide?
The molecular weight of N-(2-methylphenyl)quinoline-2-carbothioamide is 278.09 g/mol.
Where can I buy N-(2-methylphenyl)quinoline-2-carbothioamide?
You can request a quote for N-(2-methylphenyl)quinoline-2-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-methylphenyl)quinoline-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methylphenyl)quinoline-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.