Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate
TL;DR: Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate (CAS 80289-32-3) is a chemical compound with molecular formula C12H9Cl2NO5S2 and molecular weight 380.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 2,4-dichloro-5-sulfamoylbenzenesulfonate
Also Known As: EINECS 279-443-9, phenyl 2,4-dichloro-5-sulfamoylbenzenesulfonate, Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate, Phenyl 2,4-dichloro-5-sulfamoylbenzene-1-sulfonate, phenyl2,4-dichloro-5-sulphamoylbenzenesulphonate
| Molecular Formula | C12H9Cl2NO5S2 |
|---|---|
| Molecular Weight | 380.93 g/mol |
| LogP | 2.4085 |
| Topological Polar Surface Area | 103.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.92993 |
| Heavy Atoms | 22 |
| Complexity | 912.03284 |
Chemical Identifiers
| CAS Number | 80289-32-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=C(C(=C2)S(=O)(=O)N)Cl)Cl |
Product Overview
Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate (CAS 80289-32-3), with molecular formula C12H9Cl2NO5S2 and molecular weight 380.93 g/mol. IUPAC: phenyl 2,4-dichloro-5-sulfamoylbenzenesulfonate.
Chemical Property Profile of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate
Property Insights of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate
The XLogP value of 2.4085 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate. The TPSA of 103.53 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate. Following Lipinski's Rule of Five, Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate has 1 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 Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate?
The CAS number of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate is 80289-32-3.
What is the molecular formula of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate?
The molecular formula of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate is C12H9Cl2NO5S2.
What is the molecular weight of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate?
The molecular weight of Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate is 380.93 g/mol.
Where can I buy Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate?
You can request a quote for Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 2,4-dichloro-5-sulphamoylbenzenesulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.