3-(乙基氨磺酰)苯甲酸
TL;DR: 3-(乙基氨磺酰)苯甲酸 (CAS 7326-74-1) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(乙基氨磺酰)苯甲酸
3-(ethylsulfamoyl)benzoic acid
Also Known As: 3-(N-Ethylsulfamoyl)benzoic acid, 3-(ethylsulfamoyl)benzoic acid, 3-(Ethylaminosulfonyl)benzoic acid, 3-[(ethylamino)sulfonyl]benzoic acid, 3-Ethylsulfamoyl-benzoic acid
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 7326-74-1 |
|---|---|
| SMILES | CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)O |
| InChIKey | GLQZYZFUALLUSS-UHFFFAOYSA-N |
Product Overview
3-(乙基氨磺酰)苯甲酸 (CAS 7326-74-1), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: 3-(ethylsulfamoyl)benzoic acid.
Chemical Property Profile of 3-(乙基氨磺酰)苯甲酸
Property Insights of 3-(乙基氨磺酰)苯甲酸
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(乙基氨磺酰)苯甲酸. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(乙基氨磺酰)苯甲酸. Following Lipinski's Rule of Five, 3-(乙基氨磺酰)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 3-(乙基氨磺酰)苯甲酸?
The CAS number of 3-(乙基氨磺酰)苯甲酸 is 7326-74-1.
What is the molecular formula of 3-(乙基氨磺酰)苯甲酸?
The molecular formula of 3-(乙基氨磺酰)苯甲酸 is C9H11NO4S.
What is the molecular weight of 3-(乙基氨磺酰)苯甲酸?
The molecular weight of 3-(乙基氨磺酰)苯甲酸 is 229.04 g/mol.
Where can I buy 3-(乙基氨磺酰)苯甲酸?
You can request a quote for 3-(乙基氨磺酰)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 3-(乙基氨磺酰)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(乙基氨磺酰)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.