![3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid structure](/static/products/7012/701251-44-7.webp)
3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid
TL;DR: 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid (CAS 701251-44-7) is a chemical compound with molecular formula C27H28N2O4 and molecular weight 444.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(2-phenylbutanoylamino)benzoic acid
Also Known As: 3,4-bis[(2-phenylbutanoyl)amino]benzoic acid, 3,4-bis(2-phenylbutanoylamino)benzoic Acid, 3,4-BIS(2-PHENYLBUTANAMIDO)BENZOIC ACID
| Molecular Formula | C27H28N2O4 |
|---|---|
| Molecular Weight | 444.20 g/mol |
| LogP | 5.6494 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.2049 |
| Heavy Atoms | 33 |
| Complexity | 1113.48 |
Chemical Identifiers
| CAS Number | 701251-44-7 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)C(CC)C3=CC=CC=C3 |
Product Overview
3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid (CAS 701251-44-7), with molecular formula C27H28N2O4 and molecular weight 444.20 g/mol. IUPAC: 3,4-bis(2-phenylbutanoylamino)benzoic acid.
Chemical Property Profile of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid
Property Insights of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid
The XLogP value of 5.6494 indicates that 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid?
The CAS number of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid is 701251-44-7.
What is the molecular formula of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid?
The molecular formula of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid is C27H28N2O4.
What is the molecular weight of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid?
The molecular weight of 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid is 444.20 g/mol.
Where can I buy 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid?
You can request a quote for 3,4-Bis[(2-phenylbutanoyl)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-Bis[(2-phenylbutanoyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Bis[(2-phenylbutanoyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.