beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-
TL;DR: beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- (CAS 112160-85-7) is a chemical compound with molecular formula C24H35NO8 and molecular weight 465.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5S,6R)-6-[(tert-butylamino)methyl]-5-[2-(cyclopenten-1-yl)phenoxy]-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-, (2S,3S,4S,5S,6R)-6-[(tert-Butylamino)methyl]-5-[2-(cyclopent-1-en-1-yl)phenoxy]-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid, (2S,3S,4S,5S,6R)-6-[(tert-butylamino)methyl]-5-[2-(cyclopenten-1-yl)phenoxy]-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid, beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1-dimethylethyl)amino)methyl)ethyl, (S)-
| Molecular Formula | C24H35NO8 |
|---|---|
| Molecular Weight | 465.24 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 465.23627 |
| Heavy Atoms | 33 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 112160-85-7 |
|---|---|
| SMILES | CCO[C@]1([C@@]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)(O)OC2=CC=CC=C2C3=CCCC3)CNC(C)(C)C |
| InChIKey | LXPQNEIKZOEGEI-XJRISUEFSA-N |
Product Overview
beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- (CAS 112160-85-7), with molecular formula C24H35NO8 and molecular weight 465.24 g/mol. IUPAC: (2S,3S,4S,5S,6R)-6-[(tert-butylamino)methyl]-5-[2-(cyclopenten-1-yl)phenoxy]-6-ethoxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-
Property Insights of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-. Following Lipinski's Rule of Five, beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- has 5 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 beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-?
The CAS number of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- is 112160-85-7.
What is the molecular formula of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-?
The molecular formula of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- is C24H35NO8.
What is the molecular weight of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-?
The molecular weight of beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- is 465.24 g/mol.
Where can I buy beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-?
You can request a quote for beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)-?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranosiduronic acid, 2-(2-(1-cyclopenten-1-yl)phenoxy)-1-(((1,1- dimethylethyl)amino)methyl)ethyl, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.