4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole
TL;DR: 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole (CAS 2274-63-7) is a chemical compound with molecular formula C6Cl2N4O4S and molecular weight 293.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-5,7-dinitro-2,1,3-benzothiadiazole
Also Known As: 4,6-dichloro-5,7-dinitro-2,1,3-benzothiadiazole, BAS 01228896, 4,6-Dichloro-5,7-dinitro-benzo[1,2,5]thiadiazole, RefChem:285797
| Molecular Formula | C6Cl2N4O4S |
|---|---|
| Molecular Weight | 293.90 g/mol |
| LogP | 2.8145 |
| Topological Polar Surface Area | 112.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.90173 |
| Heavy Atoms | 17 |
| Complexity | 656.9931 |
Chemical Identifiers
| CAS Number | 2274-63-7 |
|---|---|
| SMILES | C1(=C(C2=NSN=C2C(=C1Cl)[N+](=O)[O-])Cl)[N+](=O)[O-] |
Product Overview
4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole (CAS 2274-63-7), with molecular formula C6Cl2N4O4S and molecular weight 293.90 g/mol. IUPAC: 4,6-dichloro-5,7-dinitro-2,1,3-benzothiadiazole.
Chemical Property Profile of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole
Property Insights of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole
The XLogP value of 2.8145 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole. The TPSA of 112.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole. Following Lipinski's Rule of Five, 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole has 0 hydrogen bond donor(s) and 7 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 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole?
The CAS number of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole is 2274-63-7.
What is the molecular formula of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole?
The molecular formula of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole is C6Cl2N4O4S.
What is the molecular weight of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole?
The molecular weight of 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole is 293.90 g/mol.
Where can I buy 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole?
You can request a quote for 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichloro-5,7-dinitro-2,1,3-benzothiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.