Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride
TL;DR: Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride (CAS 63992-38-1) is a chemical compound with molecular formula C26H39ClN4O4 and molecular weight 506.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-amino-2-[5-amino-2-[2-(diethylamino)ethoxycarbonyl]phenyl]benzoate;hydrochloride
Also Known As: 2-Biphenylarsonic acid,monosodium salt, Di- -5,5'-diaminodiphenatehydrochloride, Di-(beta-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride, Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride, 2,2'-Biphenyldicarboxylic acid, 5,5'-diamino-, bis(2-diethylaminoethyl) ester, hydrochloride
| Molecular Formula | C26H39ClN4O4 |
|---|---|
| Molecular Weight | 506.27 g/mol |
| LogP | 3.94 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 506.266 |
| Heavy Atoms | 35 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 63992-38-1 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)C2=C(C=CC(=C2)N)C(=O)OCCN(CC)CC.Cl |
| InChIKey | WFSODXBZYRVBIR-UHFFFAOYSA-N |
Product Overview
Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride (CAS 63992-38-1), with molecular formula C26H39ClN4O4 and molecular weight 506.27 g/mol. IUPAC: 2-(diethylamino)ethyl 4-amino-2-[5-amino-2-[2-(diethylamino)ethoxycarbonyl]phenyl]benzoate;hydrochloride.
Chemical Property Profile of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride
Property Insights of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride
The XLogP value of 3.94 indicates that Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride. Following Lipinski's Rule of Five, Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride has 3 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 Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride?
The CAS number of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride is 63992-38-1.
What is the molecular formula of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride?
The molecular formula of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride is C26H39ClN4O4.
What is the molecular weight of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride?
The molecular weight of Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride is 506.27 g/mol.
Where can I buy Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride?
You can request a quote for Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Di(2-diethylaminoethyl)-5,5'-diaminodiphenate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.