3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide
TL;DR: 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide (CAS 1164523-79-8) is a chemical compound with molecular formula C13H16BrNO2 and molecular weight 297.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-bromo-4-methoxyphenyl)-N-propan-2-ylprop-2-enamide
Also Known As: 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide, (E)-3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide, (E)-3-(3-bromo-4-methoxyphenyl)-N-propan-2-ylprop-2-enamide, VU0200151-4, (2E)-3-(3-bromo-4-methoxyphenyl)-N-(propan-2-yl)prop-2-enamide
| Molecular Formula | C13H16BrNO2 |
|---|---|
| Molecular Weight | 297.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.03644 |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 1164523-79-8 |
|---|---|
| SMILES | CC(C)NC(=O)/C=C/C1=CC(=C(C=C1)OC)Br |
| InChIKey | BPNVXFXSRAXIHM-FNORWQNLSA-N |
Product Overview
3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide (CAS 1164523-79-8), with molecular formula C13H16BrNO2 and molecular weight 297.04 g/mol. IUPAC: (E)-3-(3-bromo-4-methoxyphenyl)-N-propan-2-ylprop-2-enamide.
Chemical Property Profile of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide
Property Insights of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide
The XLogP value of 3.1 indicates that 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide has 1 hydrogen bond donor(s) and 2 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 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide?
The CAS number of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide is 1164523-79-8.
What is the molecular formula of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide?
The molecular formula of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide is C13H16BrNO2.
What is the molecular weight of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide?
The molecular weight of 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide is 297.04 g/mol.
Where can I buy 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide?
You can request a quote for 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-bromo-4-methoxyphenyl)-N-isopropylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.