Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate
TL;DR: Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate (CAS 106445-25-4) is a chemical compound with molecular formula C24H33NO9 and molecular weight 479.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 9-[3-(1,3-dioxoisoindol-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonanoate
Also Known As: Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate, 8-Methoxycarbonyloctyl-2-deoxy-2-phthalimido- -D-glucopyranoside, Methyl 9-[3-(1,3-dioxoisoindol-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonanoate, methyl 9-{[(2R,3R,4R,5S,6R)-3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonanoate
| Molecular Formula | C24H33NO9 |
|---|---|
| Molecular Weight | 479.22 g/mol |
| LogP | 1.0105 |
| Topological Polar Surface Area | 142.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 479.21555 |
| Heavy Atoms | 34 |
| Complexity | 825.6003 |
Chemical Identifiers
| CAS Number | 106445-25-4 |
|---|---|
| SMILES | COC(=O)CCCCCCCCOC1C(C(C(C(O1)CO)O)O)N2C(=O)C3=CC=CC=C3C2=O |
Product Overview
Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate (CAS 106445-25-4), with molecular formula C24H33NO9 and molecular weight 479.22 g/mol. IUPAC: methyl 9-[3-(1,3-dioxoisoindol-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynonanoate.
Chemical Property Profile of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate
Property Insights of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate
The XLogP value of 1.0105 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate. The TPSA of 142.83 Ų indicates high polarity, suggesting Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate has 3 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 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate?
The CAS number of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate is 106445-25-4.
What is the molecular formula of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate?
The molecular formula of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate is C24H33NO9.
What is the molecular weight of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate?
The molecular weight of Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate is 479.22 g/mol.
Where can I buy Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate?
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Does KEHONG BIO offer custom synthesis for Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 9-(((2R,3R,4R,5S,6R)-3-(1,3-dioxoisoindolin-2-yl)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)nonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.