![3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one structure](/static/products/714/714932-95-3.png)
3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
TL;DR: 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one (CAS 714932-95-3) is a chemical compound with molecular formula C20H12ClN3O3S and molecular weight 409.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-2-nitrophenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one
Also Known As: (E)-3-(4-chloro-2-nitrophenyl)-2-(2-(thiophen-2-yl)vinyl)quinazolin-4(3H)-one, 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one, 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one
| Molecular Formula | C20H12ClN3O3S |
|---|---|
| Molecular Weight | 409.03 g/mol |
| LogP | 5.1792 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.02878 |
| Heavy Atoms | 28 |
| Complexity | 1279.8457 |
Chemical Identifiers
| CAS Number | 714932-95-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=N2)/C=C/C3=CC=CS3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-] |
Product Overview
3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one (CAS 714932-95-3), with molecular formula C20H12ClN3O3S and molecular weight 409.03 g/mol. IUPAC: 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one.
Chemical Property Profile of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
Property Insights of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one
The XLogP value of 5.1792 indicates that 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)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-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The CAS number of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is 714932-95-3.
What is the molecular formula of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The molecular formula of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is C20H12ClN3O3S.
What is the molecular weight of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
The molecular weight of 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one is 409.03 g/mol.
Where can I buy 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
You can request a quote for 3-(4-chloro-2-nitrophenyl)-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 3-(4-chloro-2-nitrophenyl)-2-[(E)-2-(thiophen-2-yl)ethenyl]quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chloro-2-nitrophenyl)-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.