p-nitrophenyl N-acetyl-beta-D-glucosaminide
TL;DR: p-nitrophenyl N-acetyl-beta-D-glucosaminide (CAS 3459-18-5) is a chemical compound with molecular formula C14H18N2O8 and molecular weight 342.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]acetamide
Also Known As: GlcNAc1-b-PNP, pNPGlcNAc, pNP-GlcNAc, NP-GlcNAc, GlcNAc-b-PNP
| Molecular Formula | C14H18N2O8 |
|---|---|
| Molecular Weight | 342.11 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 154.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.10632 |
| Heavy Atoms | 24 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 3459-18-5 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC2=CC=C(C=C2)[N+](=O)[O-])CO)O)O |
| InChIKey | OMRLTNCLYHKQCK-DHGKCCLASA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-nitrophenyl N-acetyl-beta-D-glucosaminide (CAS 3459-18-5), with molecular formula C14H18N2O8 and molecular weight 342.11 g/mol. IUPAC: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]acetamide.
Chemical Property Profile of p-nitrophenyl N-acetyl-beta-D-glucosaminide
Property Insights of p-nitrophenyl N-acetyl-beta-D-glucosaminide
The XLogP value of -0.4 indicates that p-nitrophenyl N-acetyl-beta-D-glucosaminide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 154.0 Ų indicates high polarity, suggesting p-nitrophenyl N-acetyl-beta-D-glucosaminide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, p-nitrophenyl N-acetyl-beta-D-glucosaminide has 4 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 p-nitrophenyl N-acetyl-beta-D-glucosaminide?
The CAS number of p-nitrophenyl N-acetyl-beta-D-glucosaminide is 3459-18-5.
What is the molecular formula of p-nitrophenyl N-acetyl-beta-D-glucosaminide?
The molecular formula of p-nitrophenyl N-acetyl-beta-D-glucosaminide is C14H18N2O8.
What is the molecular weight of p-nitrophenyl N-acetyl-beta-D-glucosaminide?
The molecular weight of p-nitrophenyl N-acetyl-beta-D-glucosaminide is 342.11 g/mol.
Where can I buy p-nitrophenyl N-acetyl-beta-D-glucosaminide?
You can request a quote for p-nitrophenyl N-acetyl-beta-D-glucosaminide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-nitrophenyl N-acetyl-beta-D-glucosaminide?
Yes, KEHONG BIO provides custom synthesis services for p-nitrophenyl N-acetyl-beta-D-glucosaminide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.