C-473872
TL;DR: C-473872 (CAS 416876-90-9) is a chemical compound with molecular formula C41H30N2O6 and molecular weight 646.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-carboxy-4-[(4-phenylbenzoyl)amino]phenyl]methyl]-2-[(4-phenylbenzoyl)amino]benzoic acid
Also Known As: C-473872, J1.913.142D, 3,3'-Methylenebis(6-(((1,1'-biphenyl)-4-ylcarbonyl)amino)benzoic acid), Benzoic acid, 3,3'-methylenebis(6-(((1,1'-biphenyl)-4-ylcarbonyl)amino)-, 5-[[3-carboxy-4-[(4-phenylbenzoyl)amino]phenyl]methyl]-2-[(4-phenylbenzoyl)amino]benzoic Acid
| Molecular Formula | C41H30N2O6 |
|---|---|
| Molecular Weight | 646.21 g/mol |
| LogP | 8.5124 |
| Topological Polar Surface Area | 132.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 646.2104 |
| Heavy Atoms | 49 |
| Complexity | 2004.9823 |
Chemical Identifiers
| CAS Number | 416876-90-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)CC4=CC(=C(C=C4)NC(=O)C5=CC=C(C=C5)C6=CC=CC=C6)C(=O)O)C(=O)O |
Product Overview
C-473872 (CAS 416876-90-9), with molecular formula C41H30N2O6 and molecular weight 646.21 g/mol. IUPAC: 5-[[3-carboxy-4-[(4-phenylbenzoyl)amino]phenyl]methyl]-2-[(4-phenylbenzoyl)amino]benzoic acid.
Chemical Property Profile of C-473872
Property Insights of C-473872
The XLogP value of 8.5124 indicates that C-473872 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 C-473872. Following Lipinski's Rule of Five, C-473872 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C-473872?
The CAS number of C-473872 is 416876-90-9.
What is the molecular formula of C-473872?
The molecular formula of C-473872 is C41H30N2O6.
What is the molecular weight of C-473872?
The molecular weight of C-473872 is 646.21 g/mol.
Where can I buy C-473872?
You can request a quote for C-473872 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C-473872?
Yes, KEHONG BIO provides custom synthesis services for C-473872 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.