(2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide
TL;DR: (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide (CAS 1021065-22-4) is a chemical compound with molecular formula C16H12N2OS and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-isoquinolin-5-yl-3-thiophen-2-ylprop-2-enamide
Also Known As: (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide, (E)-N-isoquinolin-5-yl-3-thiophen-2-ylprop-2-enamide, (E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)acrylamide, F3301-0179
| Molecular Formula | C16H12N2OS |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.9482 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.06705 |
| Heavy Atoms | 20 |
| Complexity | 757.7576 |
Chemical Identifiers
| CAS Number | 1021065-22-4 |
|---|---|
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)NC(=O)/C=C/C3=CC=CS3 |
Product Overview
(2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide (CAS 1021065-22-4), with molecular formula C16H12N2OS and molecular weight 280.07 g/mol. IUPAC: (E)-N-isoquinolin-5-yl-3-thiophen-2-ylprop-2-enamide.
Chemical Property Profile of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide
Property Insights of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide
The XLogP value of 3.9482 indicates that (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 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)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide?
The CAS number of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide is 1021065-22-4.
What is the molecular formula of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide?
The molecular formula of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide is C16H12N2OS.
What is the molecular weight of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide?
The molecular weight of (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide is 280.07 g/mol.
Where can I buy (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide?
You can request a quote for (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-N-(isoquinolin-5-yl)-3-(thiophen-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.