4-氯-3-氨磺酰苯甲酸
TL;DR: 4-氯-3-氨磺酰苯甲酸 (CAS 1205-30-7) is a chemical compound with molecular formula C7H6ClNO4S and molecular weight 234.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯-3-氨磺酰苯甲酸
4-chloro-3-sulfamoylbenzoic acid
Also Known As: 4-Chloro-3-sulfamoylbenzoic acid, 4-Chloro-5-sulphamoylbenzoic acid, CSBA, 3-(Aminosulfonyl)-4-chlorobenzoic acid, Indapamide Impurity 3
| Molecular Formula | C7H6ClNO4S |
|---|---|
| Molecular Weight | 234.97 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.97061 |
| Heavy Atoms | 14 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 1205-30-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)S(=O)(=O)N)Cl |
| InChIKey | FHQAWINGVCDTTG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯-3-氨磺酰苯甲酸 (CAS 1205-30-7), with molecular formula C7H6ClNO4S and molecular weight 234.97 g/mol. IUPAC: 4-chloro-3-sulfamoylbenzoic acid.
Chemical Property Profile of 4-氯-3-氨磺酰苯甲酸
Property Insights of 4-氯-3-氨磺酰苯甲酸
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯-3-氨磺酰苯甲酸. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氯-3-氨磺酰苯甲酸. Following Lipinski's Rule of Five, 4-氯-3-氨磺酰苯甲酸 has 2 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 4-氯-3-氨磺酰苯甲酸?
The CAS number of 4-氯-3-氨磺酰苯甲酸 is 1205-30-7.
What is the molecular formula of 4-氯-3-氨磺酰苯甲酸?
The molecular formula of 4-氯-3-氨磺酰苯甲酸 is C7H6ClNO4S.
What is the molecular weight of 4-氯-3-氨磺酰苯甲酸?
The molecular weight of 4-氯-3-氨磺酰苯甲酸 is 234.97 g/mol.
Where can I buy 4-氯-3-氨磺酰苯甲酸?
You can request a quote for 4-氯-3-氨磺酰苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯-3-氨磺酰苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氯-3-氨磺酰苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.