7-Chloro-2,1,3-benzothiadiazol-4-amine
TL;DR: 7-Chloro-2,1,3-benzothiadiazol-4-amine (CAS 51323-01-4) is a chemical compound with molecular formula C6H4ClN3S and molecular weight 184.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2,1,3-benzothiadiazol-7-amine
Also Known As: 4-amino-7-chloro-2,1,3-benzothiadiazole, 7-chloro-2,1,3-benzothiadiazol-4-amine, 4-chloro-2,1,3-benzothiadiazol-7-amine, 2,1,3-Benzothiadiazol-4-amine, 7-chloro-, 4-Chlor-7-amino-benz[2.1.3]thiodiazol
| Molecular Formula | C6H4ClN3S |
|---|---|
| Molecular Weight | 184.98 g/mol |
| LogP | 1.9269 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.98145 |
| Heavy Atoms | 11 |
| Complexity | 361.62677 |
Chemical Identifiers
| CAS Number | 51323-01-4 |
|---|---|
| SMILES | C1=C(C2=NSN=C2C(=C1)Cl)N |
Product Overview
7-Chloro-2,1,3-benzothiadiazol-4-amine (CAS 51323-01-4), with molecular formula C6H4ClN3S and molecular weight 184.98 g/mol. IUPAC: 4-chloro-2,1,3-benzothiadiazol-7-amine.
Chemical Property Profile of 7-Chloro-2,1,3-benzothiadiazol-4-amine
Property Insights of 7-Chloro-2,1,3-benzothiadiazol-4-amine
The XLogP value of 1.9269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-2,1,3-benzothiadiazol-4-amine. With a topological polar surface area (TPSA) of 51.8 Ų, 7-Chloro-2,1,3-benzothiadiazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-2,1,3-benzothiadiazol-4-amine has 1 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 7-Chloro-2,1,3-benzothiadiazol-4-amine?
The CAS number of 7-Chloro-2,1,3-benzothiadiazol-4-amine is 51323-01-4.
What is the molecular formula of 7-Chloro-2,1,3-benzothiadiazol-4-amine?
The molecular formula of 7-Chloro-2,1,3-benzothiadiazol-4-amine is C6H4ClN3S.
What is the molecular weight of 7-Chloro-2,1,3-benzothiadiazol-4-amine?
The molecular weight of 7-Chloro-2,1,3-benzothiadiazol-4-amine is 184.98 g/mol.
Where can I buy 7-Chloro-2,1,3-benzothiadiazol-4-amine?
You can request a quote for 7-Chloro-2,1,3-benzothiadiazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-2,1,3-benzothiadiazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-2,1,3-benzothiadiazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.