N-Hydroxy-N,N'-diacetylbenzidine glucuronide
TL;DR: N-Hydroxy-N,N'-diacetylbenzidine glucuronide (CAS 89014-15-3) is a chemical compound with molecular formula C22H24N2O8 and molecular weight 444.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[4-(4-acetamidophenyl)-N-acetylanilino]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: N-Hydroxy-N,N'-diacetylbenzidine glucuronide, 1-(Acetyl(4'-(acetylamino)(1,1'-biphenyl)-4-yl)amino)-1-deoxy-beta-D-glucopyranuronic acid, beta-D-Glucopyranuronic acid, 1-(acetyl(4'-(acetylamino)(1,1'-biphenyl)-4-yl)amino)-1-deoxy-, N-Acetyl-N-{4'-[(1-hydroxyethylidene)amino][1,1'-biphenyl]-4-yl}hexopyranuronosylamine, (2S,3S,4S,5R,6R)-6-[4-(4-acetamidophenyl)-N-acetylanilino]-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C22H24N2O8 |
|---|---|
| Molecular Weight | 444.15 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.15326 |
| Heavy Atoms | 32 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 89014-15-3 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)N([C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)C(=O)C |
| InChIKey | WRWFMLKNZMWFOF-JRSUCEMESA-N |
Product Overview
N-Hydroxy-N,N'-diacetylbenzidine glucuronide (CAS 89014-15-3), with molecular formula C22H24N2O8 and molecular weight 444.15 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[4-(4-acetamidophenyl)-N-acetylanilino]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of N-Hydroxy-N,N'-diacetylbenzidine glucuronide
Property Insights of N-Hydroxy-N,N'-diacetylbenzidine glucuronide
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Hydroxy-N,N'-diacetylbenzidine glucuronide. The TPSA of 157.0 Ų indicates high polarity, suggesting N-Hydroxy-N,N'-diacetylbenzidine glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Hydroxy-N,N'-diacetylbenzidine glucuronide has 5 hydrogen bond donor(s) and 8 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 N-Hydroxy-N,N'-diacetylbenzidine glucuronide?
The CAS number of N-Hydroxy-N,N'-diacetylbenzidine glucuronide is 89014-15-3.
What is the molecular formula of N-Hydroxy-N,N'-diacetylbenzidine glucuronide?
The molecular formula of N-Hydroxy-N,N'-diacetylbenzidine glucuronide is C22H24N2O8.
What is the molecular weight of N-Hydroxy-N,N'-diacetylbenzidine glucuronide?
The molecular weight of N-Hydroxy-N,N'-diacetylbenzidine glucuronide is 444.15 g/mol.
Where can I buy N-Hydroxy-N,N'-diacetylbenzidine glucuronide?
You can request a quote for N-Hydroxy-N,N'-diacetylbenzidine glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Hydroxy-N,N'-diacetylbenzidine glucuronide?
Yes, KEHONG BIO provides custom synthesis services for N-Hydroxy-N,N'-diacetylbenzidine glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.