3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸
TL;DR: 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 (CAS 6201-80-5) is a chemical compound with molecular formula C14H12N2O7S and molecular weight 352.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸
3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfobenzoic acid
Also Known As: 3-((4-Aminobenzoyl)amino)-5-sulphosalicylic acid, 3-[ amino]-5-sulphosalicylicacid, 3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfobenzoic acid, 3-[(4-AMINOBENZOYL)AMINO]-5-SULPHOSALICYLIC ACID, Salicylic acid, 3-(p-aminobenzamido)-5-sulfo-
| Molecular Formula | C14H12N2O7S |
|---|---|
| Molecular Weight | 352.04 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.03653 |
| Heavy Atoms | 24 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 6201-80-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC(=CC(=C2O)C(=O)O)S(=O)(=O)O)N |
| InChIKey | DSANWMATXAFGTP-UHFFFAOYSA-N |
Product Overview
3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 (CAS 6201-80-5), with molecular formula C14H12N2O7S and molecular weight 352.04 g/mol. IUPAC: 3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfobenzoic acid.
Chemical Property Profile of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸
Property Insights of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸. The TPSA of 175.0 Ų indicates high polarity, suggesting 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 has 5 hydrogen bond donor(s) and 8 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-((4-氨基苯甲酰)氨基)-5-磺基水杨酸?
The CAS number of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 is 6201-80-5.
What is the molecular formula of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸?
The molecular formula of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 is C14H12N2O7S.
What is the molecular weight of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸?
The molecular weight of 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 is 352.04 g/mol.
Where can I buy 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸?
You can request a quote for 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-氨基苯甲酰)氨基)-5-磺基水杨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.