Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside
TL;DR: Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside (CAS 101223-52-3) is a chemical compound with molecular formula C16H21NO6 and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)acetamide
Also Known As: Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside, methyl 3-acetylamino-4,6-O-benzylidene-3-deoxy-, A-D-glucoside, N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)acetamide, N-(3-HYDROXY-4-METHOXY-9-PHENYL-5,8,10-TRIOXABICYCLO[4.4.0]DEC-2-YL)ACETAMIDE
| Molecular Formula | C16H21NO6 |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.1369 |
| Heavy Atoms | 23 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 101223-52-3 |
|---|---|
| SMILES | CC(=O)NC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OC)O |
| InChIKey | SZNIHFUZKXFSMY-UHFFFAOYSA-N |
Product Overview
Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside (CAS 101223-52-3), with molecular formula C16H21NO6 and molecular weight 323.14 g/mol. IUPAC: N-(7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl)acetamide.
Chemical Property Profile of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside
Property Insights of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside
The XLogP value of -0.1 indicates that Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside. Following Lipinski's Rule of Five, Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside has 2 hydrogen bond donor(s) and 6 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 Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside?
The CAS number of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside is 101223-52-3.
What is the molecular formula of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside?
The molecular formula of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside is C16H21NO6.
What is the molecular weight of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside?
The molecular weight of Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside is 323.14 g/mol.
Where can I buy Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside?
You can request a quote for Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-acetamido-4,6-O-benzylidene-3-deoxyhexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.