2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate
TL;DR: 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate (CAS 58980-56-6) is a chemical compound with molecular formula C20H35N3O3 and molecular weight 365.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-[[3-(diethylamino)-2-hydroxypropyl]amino]benzoate
Also Known As: 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate, Benzoic acid, 2-((3-(diethylamino)-2-hydroxypropyl)amino)-, 2-(diethylamino)ethyl ester, 2-(Diethylamino)ethyl 2-{[3-(diethylamino)-2-hydroxypropyl]amino}benzoate, 2-diethylaminoethyl 2-[[3-(diethylamino)-2-hydroxypropyl]amino]benzoate, BRN 2164504
| Molecular Formula | C20H35N3O3 |
|---|---|
| Molecular Weight | 365.27 g/mol |
| LogP | 2.2998 |
| Topological Polar Surface Area | 65.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 365.26785 |
| Heavy Atoms | 26 |
| Complexity | 516.7778 |
Chemical Identifiers
| CAS Number | 58980-56-6 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=CC=C1NCC(CN(CC)CC)O |
Product Overview
2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate (CAS 58980-56-6), with molecular formula C20H35N3O3 and molecular weight 365.27 g/mol. IUPAC: 2-(diethylamino)ethyl 2-[[3-(diethylamino)-2-hydroxypropyl]amino]benzoate.
Chemical Property Profile of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate
Property Insights of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate
The XLogP value of 2.2998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate. The TPSA of 65.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate has 2 hydrogen bond donor(s) and 6 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 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate?
The CAS number of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate is 58980-56-6.
What is the molecular formula of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate?
The molecular formula of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate is C20H35N3O3.
What is the molecular weight of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate?
The molecular weight of 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate is 365.27 g/mol.
Where can I buy 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate?
You can request a quote for 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl 2-((3-(diethylamino)-2-hydroxypropyl)amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.