![2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid structure](/static/products/7012/701259-00-9.webp)
2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid
TL;DR: 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid (CAS 701259-00-9) is a chemical compound with molecular formula C14H17NO7 and molecular weight 311.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-carboxybutanoylamino)-4,5-dimethoxybenzoic acid
Also Known As: 2-[(4-carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid, 2-(4-carboxybutanoylamino)-4,5-dimethoxy-benzoic Acid, 2-(4-CARBOXYBUTANAMIDO)-4,5-DIMETHOXYBENZOIC ACID, 2-[(5-hydroxy-5-oxopentanoyl)amino]-4,5-dimethoxybenzoic acid
| Molecular Formula | C14H17NO7 |
|---|---|
| Molecular Weight | 311.10 g/mol |
| LogP | 1.5954 |
| Topological Polar Surface Area | 122.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 311.1005 |
| Heavy Atoms | 22 |
| Complexity | 582.79926 |
Chemical Identifiers
| CAS Number | 701259-00-9 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)O)NC(=O)CCCC(=O)O)OC |
Product Overview
2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid (CAS 701259-00-9), with molecular formula C14H17NO7 and molecular weight 311.10 g/mol. IUPAC: 2-(4-carboxybutanoylamino)-4,5-dimethoxybenzoic acid.
Chemical Property Profile of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid
Property Insights of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid
The XLogP value of 1.5954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid. The TPSA of 122.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid. Following Lipinski's Rule of Five, 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid has 3 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 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid?
The CAS number of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid is 701259-00-9.
What is the molecular formula of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid?
The molecular formula of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid is C14H17NO7.
What is the molecular weight of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid?
The molecular weight of 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid is 311.10 g/mol.
Where can I buy 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid?
You can request a quote for 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Carboxybutanoyl)amino]-4,5-dimethoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.