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N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide structure
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N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide

TL;DR: N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide (CAS 194423-06-8) is a chemical compound with molecular formula C18H13BrN4O and molecular weight 380.02728 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[4-(3-bromoanilino)quinazolin-6-yl]but-2-ynamide

Also Known As: WAY-EKI-785, N-(4-((3-bromophenyl)amino)quinazolin-6-yl)but-2-ynamide, 4-anilinoquinazoline deriv. 1, EKI 785, CL-387,785

CAS Number
194423-06-8
Molecular Formula
C18H13BrN4O
Molecular Weight
380.02728 g/mol
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Application Areas

Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.

Biotechnology (4 patents) Heterocyclic Building Blocks (28 patents) Pharmaceutical Intermediates (53 patents)

Technical Specifications

Molecular FormulaC18H13BrN4O
Molecular Weight380.02728 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)66.9 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass380.02728 Da
Heavy Atoms24
Complexity514.0
SMILESCC#CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br
InChIKeyBTYYWOYVBXILOJ-UHFFFAOYSA-N

Product Description

Applications: N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide (CAS 194423-06-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A pharmaceutical intermediate supplied by CoreyChem, N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide (CAS 194423-06-8) has the molecular formula C18H13BrN4O and a molecular weight of 380.03 g/mol. It is also known as cl-387785 and EKI-785.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide

XLogP
4.3
TPSA (Topological Polar Surface Area)
66.9
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
24
Complexity
514.0
Exact Mass
380.02728
Monoisotopic Mass
380.02728
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide

The XLogP value of 4.3 indicates that N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide. Following Lipinski's Rule of Five, N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

The CAS number of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is 194423-06-8.

What is the molecular formula of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

The molecular formula of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is C18H13BrN4O.

What is the molecular weight of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

The molecular weight of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is 380.02728 g/mol.

What are the applications of N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem...

Where can I buy N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

You can request a quote for N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide?

Yes, CoreyChem provides custom synthesis services for N-(4-((3-bromophenyl)amino)-6-quinazolinyl)-2-butynamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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