6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid
TL;DR: 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid (CAS 443347-99-7) is a chemical compound with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoic acid
Also Known As: 6-((2-thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid, 6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoic acid, F0919-6657, 6-[(2-thioxo-1,2-dihydroquinazolin-4-yl)amino]hexanoic acid, 6-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]hexanoic acid
| Molecular Formula | C14H17N3O2S |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 3.34929 |
| Topological Polar Surface Area | 78.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.10416 |
| Heavy Atoms | 20 |
| Complexity | 654.15424 |
Chemical Identifiers
| CAS Number | 443347-99-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NC(=S)N2)NCCCCCC(=O)O |
Product Overview
6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid (CAS 443347-99-7), with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol. IUPAC: 6-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]hexanoic acid.
Chemical Property Profile of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid
Property Insights of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid
The XLogP value of 3.34929 indicates that 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid. Following Lipinski's Rule of Five, 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid has 3 hydrogen bond donor(s) and 4 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-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid?
The CAS number of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid is 443347-99-7.
What is the molecular formula of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid?
The molecular formula of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid is C14H17N3O2S.
What is the molecular weight of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid?
The molecular weight of 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid is 291.10 g/mol.
Where can I buy 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid?
You can request a quote for 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-((2-Thioxo-1,2-dihydroquinazolin-4-yl)amino)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.