2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester
TL;DR: 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester (CAS 65086-95-5) is a chemical compound with molecular formula C30H28N2O6 and molecular weight 512.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(2-benzoyloxyethyl)-4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]anilino]ethyl benzoate
Also Known As: 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester, Cinnamic acid, p-(bis(2-hydroxyethyl)amino)-alpha-cyano-, ethyl ester, dibenzoate (ester), Ethyl 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyanoacrylate, Ethyl 3-[4-[bis[2-(benzoyloxy)ethyl]amino]phenyl]-2-cyanoacrylate, 2-Propenoic acid, 3-[4-[bis[2-(benzoyloxy)ethyl]amino]phenyl]-2-cyano-, ethyl ester
| Molecular Formula | C30H28N2O6 |
|---|---|
| Molecular Weight | 512.19 g/mol |
| LogP | 4.67708 |
| Topological Polar Surface Area | 105.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 512.19476 |
| Heavy Atoms | 38 |
| Complexity | 1224.3281 |
Chemical Identifiers
| CAS Number | 65086-95-5 |
|---|---|
| SMILES | CCOC(=O)/C(=C/C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CC=C2)CCOC(=O)C3=CC=CC=C3)/C#N |
Product Overview
2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester (CAS 65086-95-5), with molecular formula C30H28N2O6 and molecular weight 512.19 g/mol. IUPAC: 2-[N-(2-benzoyloxyethyl)-4-[(E)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]anilino]ethyl benzoate.
Chemical Property Profile of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester
Property Insights of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester
The XLogP value of 4.67708 indicates that 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester has 0 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 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester?
The CAS number of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester is 65086-95-5.
What is the molecular formula of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester?
The molecular formula of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester is C30H28N2O6.
What is the molecular weight of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester?
The molecular weight of 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester is 512.19 g/mol.
Where can I buy 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester?
You can request a quote for 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(4-(bis(2-(benzoyloxy)ethyl)amino)phenyl)-2-cyano-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.