5,5'-Methylenebis(2-propionamidobenzoic acid)
TL;DR: 5,5'-Methylenebis(2-propionamidobenzoic acid) (CAS 400748-45-0) is a chemical compound with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-carboxy-4-(propanoylamino)phenyl]methyl]-2-(propanoylamino)benzoic acid
Also Known As: BAS 00333085, 5,5'-methylenebis(2-propionamidobenzoic acid), 3,3'-methanediylbis[6-(propanoylamino)benzoic acid], 5-[3-carboxy-4-(propionylamino)benzyl]-2-(propionylamino)benzoic acid, 5-[[3-carboxy-4-(propanoylamino)phenyl]methyl]-2-(propanoylamino)benzoic acid
| Molecular Formula | C21H22N2O6 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 3.3708 |
| Topological Polar Surface Area | 132.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.1478 |
| Heavy Atoms | 29 |
| Complexity | 890.13885 |
Chemical Identifiers
| CAS Number | 400748-45-0 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=C(C=C1)CC2=CC(=C(C=C2)NC(=O)CC)C(=O)O)C(=O)O |
Product Overview
5,5'-Methylenebis(2-propionamidobenzoic acid) (CAS 400748-45-0), with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol. IUPAC: 5-[[3-carboxy-4-(propanoylamino)phenyl]methyl]-2-(propanoylamino)benzoic acid.
Chemical Property Profile of 5,5'-Methylenebis(2-propionamidobenzoic acid)
Property Insights of 5,5'-Methylenebis(2-propionamidobenzoic acid)
The XLogP value of 3.3708 indicates that 5,5'-Methylenebis(2-propionamidobenzoic acid) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5'-Methylenebis(2-propionamidobenzoic acid). Following Lipinski's Rule of Five, 5,5'-Methylenebis(2-propionamidobenzoic acid) has 4 hydrogen bond donor(s) and 4 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 5,5'-Methylenebis(2-propionamidobenzoic acid)?
The CAS number of 5,5'-Methylenebis(2-propionamidobenzoic acid) is 400748-45-0.
What is the molecular formula of 5,5'-Methylenebis(2-propionamidobenzoic acid)?
The molecular formula of 5,5'-Methylenebis(2-propionamidobenzoic acid) is C21H22N2O6.
What is the molecular weight of 5,5'-Methylenebis(2-propionamidobenzoic acid)?
The molecular weight of 5,5'-Methylenebis(2-propionamidobenzoic acid) is 398.15 g/mol.
Where can I buy 5,5'-Methylenebis(2-propionamidobenzoic acid)?
You can request a quote for 5,5'-Methylenebis(2-propionamidobenzoic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-Methylenebis(2-propionamidobenzoic acid)?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-Methylenebis(2-propionamidobenzoic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.