![4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate structure](/static/products/330/330454-16-5.png)
4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate
TL;DR: 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate (CAS 330454-16-5) is a chemical compound with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-benzamido-3-(2-hydroxyethylamino)-3-oxoprop-1-enyl]phenyl] acetate
Also Known As: BAS 00690492, BIM-0025359.P001, (E)-4-(2-benzamido-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-1-yl)phenyl acetate, [4-[(E)-2-benzamido-3-(2-hydroxyethylamino)-3-oxoprop-1-enyl]phenyl] acetate, 4-{2-(benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate
| Molecular Formula | C20H20N2O5 |
|---|---|
| Molecular Weight | 368.14 g/mol |
| LogP | 1.4913 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.1372 |
| Heavy Atoms | 27 |
| Complexity | 829.2104 |
Chemical Identifiers
| CAS Number | 330454-16-5 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)/C=C(\C(=O)NCCO)/NC(=O)C2=CC=CC=C2 |
Product Overview
4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate (CAS 330454-16-5), with molecular formula C20H20N2O5 and molecular weight 368.14 g/mol. IUPAC: [4-[(E)-2-benzamido-3-(2-hydroxyethylamino)-3-oxoprop-1-enyl]phenyl] acetate.
Chemical Property Profile of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate
Property Insights of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate
The XLogP value of 1.4913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate. Following Lipinski's Rule of Five, 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate has 3 hydrogen bond donor(s) and 5 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 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate?
The CAS number of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate is 330454-16-5.
What is the molecular formula of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate?
The molecular formula of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate is C20H20N2O5.
What is the molecular weight of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate?
The molecular weight of 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate is 368.14 g/mol.
Where can I buy 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate?
You can request a quote for 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-{2-(Benzoylamino)-3-[(2-hydroxyethyl)amino]-3-oxo-1-propen-1-yl}phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.