![3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one structure](/static/products/497/497079-75-1.png)
3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
TL;DR: 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one (CAS 497079-75-1) is a chemical compound with molecular formula C18H14IN3O3 and molecular weight 447.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one
Also Known As: (E)-3-ethyl-6-iodo-2-(4-nitrostyryl)quinazolin-4(3H)-one, 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one, 3-ethyl-6-iodo-2-[2-(4-nitrophenyl)ethenyl]quinazolin-4-one, 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one
| Molecular Formula | C18H14IN3O3 |
|---|---|
| Molecular Weight | 447.01 g/mol |
| LogP | 4.0996 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.008 |
| Heavy Atoms | 25 |
| Complexity | 1039.856 |
Chemical Identifiers
| CAS Number | 497079-75-1 |
|---|---|
| SMILES | CCN1C(=NC2=C(C1=O)C=C(C=C2)I)/C=C/C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one (CAS 497079-75-1), with molecular formula C18H14IN3O3 and molecular weight 447.01 g/mol. IUPAC: 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-one.
Chemical Property Profile of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Property Insights of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
The XLogP value of 4.0996 indicates that 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one has 0 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 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one?
The CAS number of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one is 497079-75-1.
What is the molecular formula of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one?
The molecular formula of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one is C18H14IN3O3.
What is the molecular weight of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one?
The molecular weight of 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one is 447.01 g/mol.
Where can I buy 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one?
You can request a quote for 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-ethyl-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.