N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone
TL;DR: N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone (CAS 41111-85-7) is a chemical compound with molecular formula C22H27NO8 and molecular weight 433.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(cyclohexylcarbamoyl)-2-(4-methoxyphenyl)-6-oxo-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-7-yl] acetate
Also Known As: C-GAL, [4-(cyclohexylcarbamoyl)-2-(4-methoxyphenyl)-6-oxo-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-7-yl] acetate, N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone, N-Cyclohexyl-5-O-acetyl-2,4-O-(p-methoxybenzylidene)glucaro-1-amide-6,3-lactone, D-Glucar-1-amic acid, N-cyclohexyl-2,4-O-((4-methoxyphenyl)methylene)-, gamma-lactone, 5-acetate
| Molecular Formula | C22H27NO8 |
|---|---|
| Molecular Weight | 433.17 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.17368 |
| Heavy Atoms | 31 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 41111-85-7 |
|---|---|
| SMILES | CC(=O)OC1C2C(C(OC(O2)C3=CC=C(C=C3)OC)C(=O)NC4CCCCC4)OC1=O |
| InChIKey | IMKOFVXQYVDISO-UHFFFAOYSA-N |
Product Overview
N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone (CAS 41111-85-7), with molecular formula C22H27NO8 and molecular weight 433.17 g/mol. IUPAC: [4-(cyclohexylcarbamoyl)-2-(4-methoxyphenyl)-6-oxo-4,4a,7,7a-tetrahydrofuro[3,2-d][1,3]dioxin-7-yl] acetate.
Chemical Property Profile of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone
Property Insights of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone. Following Lipinski's Rule of Five, N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone has 1 hydrogen bond donor(s) and 8 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 N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone?
The CAS number of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone is 41111-85-7.
What is the molecular formula of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone?
The molecular formula of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone is C22H27NO8.
What is the molecular weight of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone?
The molecular weight of N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone is 433.17 g/mol.
Where can I buy N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone?
You can request a quote for N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone?
Yes, KEHONG BIO provides custom synthesis services for N-Cyclohexyl-5-O-acetyl-2,4-O-(4-methoxybenzylidene)glucaro-1-amide-6,3-lactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.