RefChem:1061608
TL;DR: RefChem:1061608 (CAS 2735-16-2) is a chemical compound with molecular formula C21H30Cl2N2O5 and molecular weight 460.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-(3,4-dimethoxyphenyl)-2-hydroxy-2-pyridin-3-ylacetate;dihydrochloride
Also Known As: 2-(diethylamino)ethyl(3,4-dimethoxyphenyl)(hydroxy)pyridin-3-ylacetate dihydrochloride, 2-(Diethylamino)ethyl (3,4-dimethoxyphenyl)(hydroxy)(pyridin-3-yl)acetate--hydrogen chloride (1/2), 3-Pyridineglycolic acid, alpha-(3,4-dimethoxyphenyl)-, 2-(diethylamino)ethyl ester, dihydrochloride, 2-diethylaminoethyl 2-(3,4-dimethoxyphenyl)-2-hydroxy-2-pyridin-3-ylacetate dihydrochloride, 2-diethylaminoethyl 2-(3,4-dimethoxyphenyl)-2-hydroxy-2-pyridin-3-yl-acetate Dihydrochloride
| Molecular Formula | C21H30Cl2N2O5 |
|---|---|
| Molecular Weight | 460.15 g/mol |
| LogP | 3.0633 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 460.15317 |
| Heavy Atoms | 30 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 2735-16-2 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C(C1=CC(=C(C=C1)OC)OC)(C2=CN=CC=C2)O.Cl.Cl |
| InChIKey | IBCIKQVSIDBABN-UHFFFAOYSA-N |
Product Overview
RefChem:1061608 (CAS 2735-16-2), with molecular formula C21H30Cl2N2O5 and molecular weight 460.15 g/mol. IUPAC: 2-(diethylamino)ethyl 2-(3,4-dimethoxyphenyl)-2-hydroxy-2-pyridin-3-ylacetate;dihydrochloride.
Chemical Property Profile of RefChem:1061608
Property Insights of RefChem:1061608
The XLogP value of 3.0633 indicates that RefChem:1061608 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1061608. Following Lipinski's Rule of Five, RefChem:1061608 has 3 hydrogen bond donor(s) and 7 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 RefChem:1061608?
The CAS number of RefChem:1061608 is 2735-16-2.
What is the molecular formula of RefChem:1061608?
The molecular formula of RefChem:1061608 is C21H30Cl2N2O5.
What is the molecular weight of RefChem:1061608?
The molecular weight of RefChem:1061608 is 460.15 g/mol.
Where can I buy RefChem:1061608?
You can request a quote for RefChem:1061608 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1061608?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1061608 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.