(E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide
TL;DR: (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide (CAS 428826-83-9) is a chemical compound with molecular formula C13H9IN2O3S and molecular weight 399.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide
Also Known As: AB00109485-01, F1759-0067, (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide, (2E)-N-(4-IODOPHENYL)-3-(5-NITROTHIOPHEN-2-YL)PROP-2-ENAMIDE, N-p-iodophenyl-(E)-3-(5-nitro-2-thienyl)acrylamide
| Molecular Formula | C13H9IN2O3S |
|---|---|
| Molecular Weight | 399.94 g/mol |
| LogP | 3.9128 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.93787 |
| Heavy Atoms | 20 |
| Complexity | 664.51074 |
Chemical Identifiers
| CAS Number | 428826-83-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)/C=C/C2=CC=C(S2)[N+](=O)[O-])I |
Product Overview
(E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide (CAS 428826-83-9), with molecular formula C13H9IN2O3S and molecular weight 399.94 g/mol. IUPAC: (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)prop-2-enamide.
Chemical Property Profile of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide
Property Insights of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide
The XLogP value of 3.9128 indicates that (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide. Following Lipinski's Rule of Five, (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide has 1 hydrogen bond donor(s) and 4 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-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide?
The CAS number of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide is 428826-83-9.
What is the molecular formula of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide?
The molecular formula of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide is C13H9IN2O3S.
What is the molecular weight of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide?
The molecular weight of (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide is 399.94 g/mol.
Where can I buy (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide?
You can request a quote for (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(4-iodophenyl)-3-(5-nitrothiophen-2-yl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.