3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one
TL;DR: 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one (CAS 433259-76-8) is a chemical compound with molecular formula C15H9IN4OS and molecular weight 419.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,1,3-benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one
Also Known As: AN-023/40954198, 3-(2,1,3-benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one, 3-(2,1,3-benzothiadiazol-5-yl)-6-iodo-2-methyl-4(3H)-quinazolinone, Cambridge id 6889264
| Molecular Formula | C15H9IN4OS |
|---|---|
| Molecular Weight | 419.95 g/mol |
| LogP | 3.30342 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 419.9542 |
| Heavy Atoms | 22 |
| Complexity | 1085.981 |
Chemical Identifiers
| CAS Number | 433259-76-8 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC4=NSN=C4C=C3 |
Product Overview
3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one (CAS 433259-76-8), with molecular formula C15H9IN4OS and molecular weight 419.95 g/mol. IUPAC: 3-(2,1,3-benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one.
Chemical Property Profile of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one
Property Insights of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one
The XLogP value of 3.30342 indicates that 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one. Following Lipinski's Rule of Five, 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one has 0 hydrogen bond donor(s) and 5 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 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one?
The CAS number of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one is 433259-76-8.
What is the molecular formula of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one?
The molecular formula of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one is C15H9IN4OS.
What is the molecular weight of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one?
The molecular weight of 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one is 419.95 g/mol.
Where can I buy 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one?
You can request a quote for 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,1,3-Benzothiadiazol-5-yl)-6-iodo-2-methylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.