![(E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide structure](/static/products/331/331463-72-0.png)
(E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
TL;DR: (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide (CAS 331463-72-0) is a chemical compound with molecular formula C23H26N2O6 and molecular weight 426.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
Also Known As: (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide, N-(2-(1,3-benzodioxol-5-yl)-1-{[(2-hydroxyethyl)amino]carbonyl}vinyl)-4-isobutoxybenzamide, N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide, N-[2-benzo[1,3]dioxol-5-yl-1-(2-hydroxyethylcarbamoyl)ethenyl]-4-(2-methylpropoxy)benzamide, N-{(1E)-1-(1,3-benzodioxol-5-yl)-3-[(2-hydroxyethyl)amino]-3-oxoprop-1-en-2-yl}-4-(2-methylpropoxy)benzamide
| Molecular Formula | C23H26N2O6 |
|---|---|
| Molecular Weight | 426.18 g/mol |
| LogP | 2.3295 |
| Topological Polar Surface Area | 106.12 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 426.17908 |
| Heavy Atoms | 31 |
| Complexity | 953.0391 |
Chemical Identifiers
| CAS Number | 331463-72-0 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC3=C(C=C2)OCO3)/C(=O)NCCO |
Product Overview
(E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide (CAS 331463-72-0), with molecular formula C23H26N2O6 and molecular weight 426.18 g/mol. IUPAC: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide.
Chemical Property Profile of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
Property Insights of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
The XLogP value of 2.3295 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide. The TPSA of 106.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide. Following Lipinski's Rule of Five, (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide has 3 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 (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The CAS number of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is 331463-72-0.
What is the molecular formula of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The molecular formula of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is C23H26N2O6.
What is the molecular weight of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The molecular weight of (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is 426.18 g/mol.
Where can I buy (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
You can request a quote for (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(1-(benzo[d][1,3]dioxol-5-yl)-3-((2-hydroxyethyl)amino)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.