Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside
TL;DR: Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside (CAS 16203-25-1) is a chemical compound with molecular formula C20H24O9S2 and molecular weight 472.08618 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-hydroxy-5-methoxy-3-(4-methylphenyl)sulfonyloxyoxolan-2-yl]methyl 4-methylbenzenesulfonate
Also Known As: methyl 3,5-bis-o-[(4-methylphenyl)sulfonyl]pentofuranoside, Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside, [4-hydroxy-5-methoxy-3-(4-methylphenyl)sulfonyloxyoxolan-2-yl]methyl 4-methylbenzenesulfonate
Technical Specifications
| Molecular Formula | C20H24O9S2 |
| Molecular Weight | 472.08618 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 472.08618 Da |
| Heavy Atoms | 31 |
| Complexity | 770.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(O2)OC)O)OS(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | UDTDTEUOSXDIRV-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside
Property Insights of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside. The TPSA of 142.0 Ų indicates high polarity, suggesting Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside 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
What is the CAS number of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside?
The CAS number of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside is 16203-25-1.
What is the molecular formula of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside?
The molecular formula of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside is C20H24O9S2.
What is the molecular weight of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside?
The molecular weight of Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside is 472.08618 g/mol.
Where can I buy Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside?
You can request a quote for Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside?
Yes, CoreyChem provides custom synthesis services for Methyl 3,5-bis-O-(4-methylbenzene-1-sulfonyl)pentofuranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.