![4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid structure](/static/products/334/334506-72-8.png)
4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid
TL;DR: 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid (CAS 334506-72-8) is a chemical compound with molecular formula C18H25NO5 and molecular weight 335.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-carboxy-3,7-dimethyloctanoyl)amino]benzoic acid
Also Known As: 4-(4-carboxy-3,7-dimethyloctanamido)benzoic acid, 4-[(4-carboxy-3,7-dimethyloctanoyl)amino]benzoic acid, 2-[1-[(4-carboxyphenyl)carbamoyl]propan-2-yl]-5-methyl-hexanoic Acid, 4-[4-CARBOXY-3-METHYL-4-(3-METHYLBUTYL)BUTANAMIDO]BENZOIC ACID
| Molecular Formula | C18H25NO5 |
|---|---|
| Molecular Weight | 335.17 g/mol |
| LogP | 3.4865 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 335.17328 |
| Heavy Atoms | 24 |
| Complexity | 579.57684 |
Chemical Identifiers
| CAS Number | 334506-72-8 |
|---|---|
| SMILES | CC(C)CCC(C(C)CC(=O)NC1=CC=C(C=C1)C(=O)O)C(=O)O |
Product Overview
4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid (CAS 334506-72-8), with molecular formula C18H25NO5 and molecular weight 335.17 g/mol. IUPAC: 4-[(4-carboxy-3,7-dimethyloctanoyl)amino]benzoic acid.
Chemical Property Profile of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid
Property Insights of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid
The XLogP value of 3.4865 indicates that 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 4-[(4-Carboxy-3,7-dimethyloctanoyl)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 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid?
The CAS number of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid is 334506-72-8.
What is the molecular formula of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid?
The molecular formula of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid is C18H25NO5.
What is the molecular weight of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid?
The molecular weight of 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid is 335.17 g/mol.
Where can I buy 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid?
You can request a quote for 4-[(4-Carboxy-3,7-dimethyloctanoyl)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 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Carboxy-3,7-dimethyloctanoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.