1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-
TL;DR: 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- (CAS 39148-55-5) is a chemical compound with molecular formula C14H21NO8 and molecular weight 331.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: KST-1B3868, 1,3-dioxooctahydro-1h-isoindol-4-yl, A-d-glucopyranoside, 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-, 3-Hydroxy-1-oxo-3a,4,5,6,7,7a-hexahydro-1H-isoindol-7-yl hexopyranoside
| Molecular Formula | C14H21NO8 |
|---|---|
| Molecular Weight | 331.13 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.1267 |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
Chemical Identifiers
| CAS Number | 39148-55-5 |
|---|---|
| SMILES | C1CC2C(C(C1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)NC2=O |
| InChIKey | FEVUHLUQXXYKOG-JJMJTXMNSA-N |
Product Overview
1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- (CAS 39148-55-5), with molecular formula C14H21NO8 and molecular weight 331.13 g/mol. IUPAC: 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-
Property Insights of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-
The XLogP value of -2.3 indicates that 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- has 5 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 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-?
The CAS number of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- is 39148-55-5.
What is the molecular formula of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-?
The molecular formula of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- is C14H21NO8.
What is the molecular weight of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-?
The molecular weight of 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- is 331.13 g/mol.
Where can I buy 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-?
You can request a quote for 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Cyclohexanedicarboximide, 3-(beta-D-glucopyranosyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.