4358-1716 Screening compound: ethyl 3-[(quinazolin-4-yl)amino]benzoate

4358-1716 Screening compound: ethyl 3-[(quinazolin-4-yl)amino]benzoate
4358-1716 Screening compound: ethyl 3-[(quinazolin-4-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4358-1716
ethyl 3-[(quinazolin-4-yl)amino]benzoate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4358-1716

Molecular Formula

C17H15N3O2 (C17 H15 N3 O2)

Compound Name

ethyl 3-[(quinazolin-4-yl)amino]benzoate

IUPAC name

ethyl 3-[(quinazolin-4-yl)amino]benzoate

SMILES

CCOC(c1cc(Nc2ncnc3ccccc23)ccc1)=O

InChI

InChI=1S/C17H15N3O2/c1-2-22-17(21)12-6-5-7-13(10-12)20-16-14-8-3-4-9-15(14)18-11-19-16/h3-11H,2H2,1H3,(H,18,19,20)

InChI Key

QTUXXVZVIPFIOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05239194

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

293.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.369

Distribution Coefficient, logD

4.367

Water Solubility, LogSw

-4.31

Polar Surface Area

50.069

Acid Dissociation Constant (pKa)

17.53

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

4358-1716 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Lipid Metabolism Library (9174 compounds)

Proline Kinase Library (2105 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 4358-1716 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4358-1716?
Check Price and Availability of 4358-1716, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4358-1716 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4358-1716
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4358-1716
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4358-1716 available by request