5-24-04-00368 (Beilstein Handbook Reference)
TL;DR: 5-24-04-00368 (Beilstein Handbook Reference) (CAS 73013-18-0) is a chemical compound with molecular formula C17H9Cl2F3N2O3 and molecular weight 415.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6,8-dichloro-4-oxo-2-[3-(trifluoromethyl)phenyl]quinazolin-3-yl]acetic acid
Also Known As: 5-24-04-00368 (Beilstein Handbook Reference), 3(4H)-Quinazolineacetic acid, 6,8-dichloro-4-oxo-2-(alpha,alpha,alpha-trifluoro-m-tolyl)-, 6,8-Dichloro-4-oxo-2-(m-(alpha-trifluoro)tolyl)-3(4H)-quinazolineacetic acid, 6,8-Dichloro-4-oxo-2-(m-trifluoromethylphenyl)-3(4H)-quinazolineacetic acid, {6,8-Dichloro-4-oxo-2-[3-(trifluoromethyl)phenyl]quinazolin-3(4H)-yl}acetic acid
| Molecular Formula | C17H9Cl2F3N2O3 |
|---|---|
| Molecular Weight | 415.99 g/mol |
| LogP | 4.4737 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.99423 |
| Heavy Atoms | 27 |
| Complexity | 1126.8323 |
Chemical Identifiers
| CAS Number | 73013-18-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=NC3=C(C=C(C=C3Cl)Cl)C(=O)N2CC(=O)O |
Product Overview
5-24-04-00368 (Beilstein Handbook Reference) (CAS 73013-18-0), with molecular formula C17H9Cl2F3N2O3 and molecular weight 415.99 g/mol. IUPAC: 2-[6,8-dichloro-4-oxo-2-[3-(trifluoromethyl)phenyl]quinazolin-3-yl]acetic acid.
Chemical Property Profile of 5-24-04-00368 (Beilstein Handbook Reference)
Property Insights of 5-24-04-00368 (Beilstein Handbook Reference)
The XLogP value of 4.4737 indicates that 5-24-04-00368 (Beilstein Handbook Reference) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-24-04-00368 (Beilstein Handbook Reference). Following Lipinski's Rule of Five, 5-24-04-00368 (Beilstein Handbook Reference) has 1 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 5-24-04-00368 (Beilstein Handbook Reference)?
The CAS number of 5-24-04-00368 (Beilstein Handbook Reference) is 73013-18-0.
What is the molecular formula of 5-24-04-00368 (Beilstein Handbook Reference)?
The molecular formula of 5-24-04-00368 (Beilstein Handbook Reference) is C17H9Cl2F3N2O3.
What is the molecular weight of 5-24-04-00368 (Beilstein Handbook Reference)?
The molecular weight of 5-24-04-00368 (Beilstein Handbook Reference) is 415.99 g/mol.
Where can I buy 5-24-04-00368 (Beilstein Handbook Reference)?
You can request a quote for 5-24-04-00368 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-24-04-00368 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-24-04-00368 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.