![6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one structure](/static/products/694/694475-36-0.png)
6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
TL;DR: 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one (CAS 694475-36-0) is a chemical compound with molecular formula C22H17IN2OS and molecular weight 484.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-3-(2-phenylethyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one
Also Known As: 6-iodo-3-phenethyl-2-(2-thiophen-2-ylethenyl)quinazolin-4-one, 6-iodo-3-phenethyl-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one, (E)-6-iodo-3-phenethyl-2-(2-(thiophen-2-yl)vinyl)quinazolin-4(3H)-one, 6-iodo-3-(2-phenylethyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one, 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
| Molecular Formula | C22H17IN2OS |
|---|---|
| Molecular Weight | 484.01 g/mol |
| LogP | 5.4757 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 484.01062 |
| Heavy Atoms | 27 |
| Complexity | 1148.3752 |
Chemical Identifiers
| CAS Number | 694475-36-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=CS4 |
Product Overview
6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one (CAS 694475-36-0), with molecular formula C22H17IN2OS and molecular weight 484.01 g/mol. IUPAC: 6-iodo-3-(2-phenylethyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one.
Chemical Property Profile of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
Property Insights of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
The XLogP value of 5.4757 indicates that 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The CAS number of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is 694475-36-0.
What is the molecular formula of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The molecular formula of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is C22H17IN2OS.
What is the molecular weight of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The molecular weight of 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is 484.01 g/mol.
Where can I buy 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
You can request a quote for 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)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 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-iodo-3-(2-phenylethyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.