![3-[(4-Carboxyoctanoyl)amino]benzoic acid structure](/static/products/893/893665-20-8.png)
3-[(4-Carboxyoctanoyl)amino]benzoic acid
TL;DR: 3-[(4-Carboxyoctanoyl)amino]benzoic acid (CAS 893665-20-8) is a chemical compound with molecular formula C16H21NO5 and molecular weight 307.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-carboxyoctanoylamino)benzoic acid
Also Known As: 3-(4-carboxyoctanoylamino)benzoic acid, 3-(4-carboxyoctanamido)benzoic acid, 3-[(4-carboxyoctanoyl)amino]benzoic acid, 3-(4-BUTYL-4-CARBOXYBUTANAMIDO)BENZOIC ACID, 2-[2-[(3-carboxyphenyl)carbamoyl]ethyl]hexanoic Acid
| Molecular Formula | C16H21NO5 |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 2.9945 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 307.14197 |
| Heavy Atoms | 22 |
| Complexity | 541.09265 |
Chemical Identifiers
| CAS Number | 893665-20-8 |
|---|---|
| SMILES | CCCCC(CCC(=O)NC1=CC=CC(=C1)C(=O)O)C(=O)O |
Product Overview
3-[(4-Carboxyoctanoyl)amino]benzoic acid (CAS 893665-20-8), with molecular formula C16H21NO5 and molecular weight 307.14 g/mol. IUPAC: 3-(4-carboxyoctanoylamino)benzoic acid.
Chemical Property Profile of 3-[(4-Carboxyoctanoyl)amino]benzoic acid
Property Insights of 3-[(4-Carboxyoctanoyl)amino]benzoic acid
The XLogP value of 2.9945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Carboxyoctanoyl)amino]benzoic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-Carboxyoctanoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(4-Carboxyoctanoyl)amino]benzoic acid has 3 hydrogen bond donor(s) and 3 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-Carboxyoctanoyl)amino]benzoic acid?
The CAS number of 3-[(4-Carboxyoctanoyl)amino]benzoic acid is 893665-20-8.
What is the molecular formula of 3-[(4-Carboxyoctanoyl)amino]benzoic acid?
The molecular formula of 3-[(4-Carboxyoctanoyl)amino]benzoic acid is C16H21NO5.
What is the molecular weight of 3-[(4-Carboxyoctanoyl)amino]benzoic acid?
The molecular weight of 3-[(4-Carboxyoctanoyl)amino]benzoic acid is 307.14 g/mol.
Where can I buy 3-[(4-Carboxyoctanoyl)amino]benzoic acid?
You can request a quote for 3-[(4-Carboxyoctanoyl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Carboxyoctanoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Carboxyoctanoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.