3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside
TL;DR: 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside (CAS 50729-96-9) is a chemical compound with molecular formula C15H21NO6 and molecular weight 311.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(3-methylphenoxy)oxan-3-yl]acetamide
Also Known As: 3-methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside, 3'-METHYLPHENYL 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSIDE, 3-Methylphenyl 2-acetamido-3,4,6-tri-O-acetyl-2-deoxy-b-D-glucopyranoside, N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(3-methylphenoxy)oxan-3-yl]acetamide
| Molecular Formula | C15H21NO6 |
|---|---|
| Molecular Weight | 311.14 g/mol |
| LogP | -0.68248 |
| Topological Polar Surface Area | 108.25 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.1369 |
| Heavy Atoms | 22 |
| Complexity | 522.5091 |
Chemical Identifiers
| CAS Number | 50729-96-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OC2C(C(C(C(O2)CO)O)O)NC(=O)C |
Product Overview
3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside (CAS 50729-96-9), with molecular formula C15H21NO6 and molecular weight 311.14 g/mol. IUPAC: N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(3-methylphenoxy)oxan-3-yl]acetamide.
Chemical Property Profile of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside
Property Insights of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside
The XLogP value of -0.68248 indicates that 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside. Following Lipinski's Rule of Five, 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside has 4 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 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside?
The CAS number of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside is 50729-96-9.
What is the molecular formula of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside?
The molecular formula of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside is C15H21NO6.
What is the molecular weight of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside?
The molecular weight of 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside is 311.14 g/mol.
Where can I buy 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside?
You can request a quote for 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylphenyl 2-(acetylamino)-2-deoxyhexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.