![N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide structure](/static/products/1304/13041-95-7.webp)
N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide
TL;DR: N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide (CAS 13041-95-7) is a chemical compound with molecular formula C26H18N4S2 and molecular weight 450.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide
Also Known As: N,N'-1,4-Phenylenebis[2-quinolinecarbothioamide], N,N'-1,4-phenylenedi(2-quinolinecarbothioamide), N,N'-(1,4-Phenylene)di(quinoline-2-carbothioamide), N,Na(2)-1,4-Phenylenebis[2-quinolinecarbothioamide], N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide
| Molecular Formula | C26H18N4S2 |
|---|---|
| Molecular Weight | 450.10 g/mol |
| LogP | 6.3582 |
| Topological Polar Surface Area | 49.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.0973 |
| Heavy Atoms | 32 |
| Complexity | 1349.988 |
Chemical Identifiers
| CAS Number | 13041-95-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=N2)C(=S)NC3=CC=C(C=C3)NC(=S)C4=NC5=CC=CC=C5C=C4 |
Product Overview
N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide (CAS 13041-95-7), with molecular formula C26H18N4S2 and molecular weight 450.10 g/mol. IUPAC: N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide.
Chemical Property Profile of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide
Property Insights of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide
The XLogP value of 6.3582 indicates that N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.84 Ų, N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide?
The CAS number of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide is 13041-95-7.
What is the molecular formula of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide?
The molecular formula of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide is C26H18N4S2.
What is the molecular weight of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide?
The molecular weight of N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide is 450.10 g/mol.
Where can I buy N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide?
You can request a quote for N-[4-(quinoline-2-carbothioylamino)phenyl]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-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(quinoline-2-carbothioylamino)phenyl]quinoline-2-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.