1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol
TL;DR: 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol (CAS 129258-95-3) is a chemical compound with molecular formula C16H27NO7 and molecular weight 345.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(3,4-dimethoxyphenyl)ethylamino]hexane-1,2,3,4,5-pentol
Also Known As: 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol, 6-[2-(3,4-dimethoxyphenyl)ethylamino]hexane-1,2,3,4,5-pentol, AE-018/31866001, 6-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1,2,3,4,5-hexanepentol
| Molecular Formula | C16H27NO7 |
|---|---|
| Molecular Weight | 345.18 g/mol |
| LogP | -1.7282 |
| Topological Polar Surface Area | 131.64 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 345.17874 |
| Heavy Atoms | 24 |
| Complexity | 485.49377 |
Chemical Identifiers
| CAS Number | 129258-95-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNCC(C(C(C(CO)O)O)O)O)OC |
Product Overview
1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol (CAS 129258-95-3), with molecular formula C16H27NO7 and molecular weight 345.18 g/mol. IUPAC: 6-[2-(3,4-dimethoxyphenyl)ethylamino]hexane-1,2,3,4,5-pentol.
Chemical Property Profile of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol
Property Insights of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol
The XLogP value of -1.7282 indicates that 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol. Following Lipinski's Rule of Five, 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol?
The CAS number of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol is 129258-95-3.
What is the molecular formula of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol?
The molecular formula of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol is C16H27NO7.
What is the molecular weight of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol?
The molecular weight of 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol is 345.18 g/mol.
Where can I buy 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol?
You can request a quote for 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol?
Yes, KEHONG BIO provides custom synthesis services for 1-Deoxy-1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-D-glucitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.