(2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one
TL;DR: (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one (CAS 204841-35-0) is a chemical compound with molecular formula C17H15NO4 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)prop-2-en-1-one
Also Known As: J1.291.622A, 1-(6-Amino-1,3-benzodioxole-5-yl)-3-(3-methoxyphenyl)-2-propene-1-one, 1-(6-amino-2H-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)prop-2-en-1-one, (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one, (2E)-1-(6-Amino-2H-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)prop-2-en-1-one
| Molecular Formula | C17H15NO4 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 2.9022 |
| Topological Polar Surface Area | 70.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.1001 |
| Heavy Atoms | 22 |
| Complexity | 752.31934 |
Chemical Identifiers
| CAS Number | 204841-35-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)/C=C/C(=O)C2=CC3=C(C=C2N)OCO3 |
Product Overview
(2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one (CAS 204841-35-0), with molecular formula C17H15NO4 and molecular weight 297.10 g/mol. IUPAC: (E)-1-(6-amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one
Property Insights of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one
The XLogP value of 2.9022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one. The TPSA of 70.78 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one. Following Lipinski's Rule of Five, (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one 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 (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one?
The CAS number of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one is 204841-35-0.
What is the molecular formula of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one?
The molecular formula of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one is C17H15NO4.
What is the molecular weight of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one?
The molecular weight of (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one is 297.10 g/mol.
Where can I buy (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one?
You can request a quote for (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-1-(6-Amino-1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-2-propen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.