2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside
TL;DR: 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside (CAS 309267-86-5) is a chemical compound with molecular formula C18H29NO9 and molecular weight 403.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(2-methylpropoxy)oxan-2-yl]methyl acetate
Also Known As: 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside, (2R,3S,4R,5R,6R)-5-acetamido-2-(acetoxymethyl)-6-isobutoxytetrahydro-2H-pyran-3,4-diyl diacetate, [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(2-methylpropoxy)oxan-2-yl]methyl acetate
| Molecular Formula | C18H29NO9 |
|---|---|
| Molecular Weight | 403.18 g/mol |
| LogP | 0.3151 |
| Topological Polar Surface Area | 126.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.18423 |
| Heavy Atoms | 28 |
| Complexity | 577.40356 |
Chemical Identifiers
| CAS Number | 309267-86-5 |
|---|---|
| SMILES | CC(C)CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C |
Product Overview
2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside (CAS 309267-86-5), with molecular formula C18H29NO9 and molecular weight 403.18 g/mol. IUPAC: [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-(2-methylpropoxy)oxan-2-yl]methyl acetate.
Chemical Property Profile of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside
Property Insights of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside
The XLogP value of 0.3151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside. The TPSA of 126.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside. Following Lipinski's Rule of Five, 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside has 1 hydrogen bond donor(s) and 9 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 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside?
The CAS number of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside is 309267-86-5.
What is the molecular formula of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside?
The molecular formula of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside is C18H29NO9.
What is the molecular weight of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside?
The molecular weight of 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside is 403.18 g/mol.
Where can I buy 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside?
You can request a quote for 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 2-methylpropyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.