Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside
TL;DR: Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside (CAS 14225-80-0) is a chemical compound with molecular formula C22H24O9S and molecular weight 464.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-acetyloxy-2-methoxy-4-(4-methylphenyl)sulfonyloxyoxan-3-yl] benzoate
Also Known As: methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside, [5-acetyloxy-2-methoxy-4-(4-methylphenyl)sulfonyloxyoxan-3-yl] benzoate, Methyl 4-O-acetyl-2-O-benzoyl-3-O-(4-methylbenzene-1-sulfonyl)pentopyranoside
| Molecular Formula | C22H24O9S |
|---|---|
| Molecular Weight | 464.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 464.1141 |
| Heavy Atoms | 32 |
| Complexity | 733.0 |
Chemical Identifiers
| CAS Number | 14225-80-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2C(COC(C2OC(=O)C3=CC=CC=C3)OC)OC(=O)C |
| InChIKey | HOIPUGLPGISLIL-UHFFFAOYSA-N |
Product Overview
Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside (CAS 14225-80-0), with molecular formula C22H24O9S and molecular weight 464.11 g/mol. IUPAC: [5-acetyloxy-2-methoxy-4-(4-methylphenyl)sulfonyloxyoxan-3-yl] benzoate.
Chemical Property Profile of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside
Property Insights of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside. Following Lipinski's Rule of Five, Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside has 0 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 Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside?
The CAS number of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside is 14225-80-0.
What is the molecular formula of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside?
The molecular formula of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside is C22H24O9S.
What is the molecular weight of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside?
The molecular weight of Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside is 464.11 g/mol.
Where can I buy Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside?
You can request a quote for Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-o-acetyl-2-o-benzoyl-3-o-[(4-methylphenyl)sulfonyl]pentopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.