2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide
TL;DR: 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide (CAS 359-87-5) is a chemical compound with molecular formula C7H4Cl2N2O2S and molecular weight 249.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dichloro-4H-1λ6,2,4-benzothiadiazine 1,1-dioxide
Also Known As: 6,7-dichloro-4H-1, 2-(methylsulfonyl)benzoic acid, 6,7-Dichloro-2H-1,2,4-benzothiadiazine 1,1-dioxide, 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide, 6,7-Dicloro-2H-1,2,4-benzotiodiazina 1,1-diossido
| Molecular Formula | C7H4Cl2N2O2S |
|---|---|
| Molecular Weight | 249.94 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.93706 |
| Heavy Atoms | 14 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 359-87-5 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Cl)Cl)S(=O)(=O)N=CN2 |
| InChIKey | AOSLDRBVMZNIQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide (CAS 359-87-5), with molecular formula C7H4Cl2N2O2S and molecular weight 249.94 g/mol. IUPAC: 6,7-dichloro-4H-1λ6,2,4-benzothiadiazine 1,1-dioxide.
Chemical Property Profile of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide
Property Insights of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide. Following Lipinski's Rule of Five, 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide 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 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide?
The CAS number of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide is 359-87-5.
What is the molecular formula of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide?
The molecular formula of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide is C7H4Cl2N2O2S.
What is the molecular weight of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide?
The molecular weight of 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide is 249.94 g/mol.
Where can I buy 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide?
You can request a quote for 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,2,4-Benzothiadiazine, 6,7-dichloro-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.