beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl
TL;DR: beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl (CAS 85559-84-8) is a chemical compound with molecular formula C22H24N2O9 and molecular weight 460.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-[2-acetamido-5-(4-acetamidophenyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: 3-Hydroxy-N,N'-diacetylbenzidine glucuronide, beta-d-glucopyranosiduronicacid,4,4'-bis -3-yl, beta-D-Glucopyranosiduronicacid,4,4'-bis -3-yl, beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl, 4,4'-Bis[(1-hydroxyethylidene)amino][1,1'-biphenyl]-3-yl beta-D-glucopyranosiduronic acid
| Molecular Formula | C22H24N2O9 |
|---|---|
| Molecular Weight | 460.15 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.1482 |
| Heavy Atoms | 33 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 85559-84-8 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=CC(=C(C=C2)NC(=O)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
| InChIKey | MPJJSEHOPYUSQR-SXFAUFNYSA-N |
Product Overview
beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl (CAS 85559-84-8), with molecular formula C22H24N2O9 and molecular weight 460.15 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-[2-acetamido-5-(4-acetamidophenyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl
Property Insights of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl. The TPSA of 175.0 Ų indicates high polarity, suggesting beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl?
The CAS number of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl is 85559-84-8.
What is the molecular formula of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl?
The molecular formula of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl is C22H24N2O9.
What is the molecular weight of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl?
The molecular weight of beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl is 460.15 g/mol.
Where can I buy beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl?
You can request a quote for beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranosiduronic acid, 4,4'-bis(acetylamino)(1,1'-biphenyl)-3-yl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.