![(Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate structure](/static/products/799/799835-83-9.png)
(Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate
TL;DR: (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate (CAS 799835-83-9) is a chemical compound with molecular formula C21H21NO5 and molecular weight 367.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl (Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate
Also Known As: (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate, 2-methylpropyl (Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate, 2-methylpropyl (2Z)-3-(1,3-benzodioxol-5-yl)-2-[(phenylcarbonyl)amino]prop-2-enoate
| Molecular Formula | C21H21NO5 |
|---|---|
| Molecular Weight | 367.14 g/mol |
| LogP | 3.3854 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.14197 |
| Heavy Atoms | 27 |
| Complexity | 858.1306 |
Chemical Identifiers
| CAS Number | 799835-83-9 |
|---|---|
| SMILES | CC(C)COC(=O)/C(=C/C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC=CC=C3 |
Product Overview
(Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate (CAS 799835-83-9), with molecular formula C21H21NO5 and molecular weight 367.14 g/mol. IUPAC: 2-methylpropyl (Z)-2-benzamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate.
Chemical Property Profile of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate
Property Insights of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate
The XLogP value of 3.3854 indicates that (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate. Following Lipinski's Rule of Five, (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate has 1 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 (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate?
The CAS number of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate is 799835-83-9.
What is the molecular formula of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate?
The molecular formula of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate is C21H21NO5.
What is the molecular weight of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate?
The molecular weight of (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate is 367.14 g/mol.
Where can I buy (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate?
You can request a quote for (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-isobutyl 2-benzamido-3-(benzo[d][1,3]dioxol-5-yl)acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.