5,7-Dichloro-2,1,3-benzothiadiazol-4-amine
TL;DR: 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine (CAS 16407-86-6) is a chemical compound with molecular formula C6H3Cl2N3S and molecular weight 218.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dichloro-2,1,3-benzothiadiazol-4-amine
Also Known As: 5,7-dichloro-2,1,3-benzothiadiazol-4-amine, 4-amino-5,7-dichloro-2,1,3-benzothiadiazol, 4-Amino-5,7-dichloro-2,1,3-benzothiadiazole, 5,7-Dichlorobenzo[c][1,2,5]thiadiazol-4-amine, 5,7-dichloro-2??,1,3-benzothiadiazol-4-amine
| Molecular Formula | C6H3Cl2N3S |
|---|---|
| Molecular Weight | 218.94 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.94247 |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 16407-86-6 |
|---|---|
| SMILES | C1=C(C2=NSN=C2C(=C1Cl)N)Cl |
| InChIKey | BHDCZIZWPKHDHA-UHFFFAOYSA-N |
Product Overview
5,7-Dichloro-2,1,3-benzothiadiazol-4-amine (CAS 16407-86-6), with molecular formula C6H3Cl2N3S and molecular weight 218.94 g/mol. IUPAC: 5,7-dichloro-2,1,3-benzothiadiazol-4-amine.
Chemical Property Profile of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine
Property Insights of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine. Following Lipinski's Rule of Five, 5,7-Dichloro-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 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine?
The CAS number of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine is 16407-86-6.
What is the molecular formula of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine?
The molecular formula of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine is C6H3Cl2N3S.
What is the molecular weight of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine?
The molecular weight of 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine is 218.94 g/mol.
Where can I buy 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine?
You can request a quote for 5,7-Dichloro-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 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 5,7-Dichloro-2,1,3-benzothiadiazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.