4229-0059 Screening compound: 2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol

4229-0059 Screening compound: 2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol
4229-0059 Screening compound: 2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4229-0059
2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol

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

4229-0059

Molecular Formula

C20H14FN3O (C20 H14 FN3 O)

Compound Name

2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol

IUPAC name

2-{4-[(3-fluorophenyl)amino]quinazolin-2-yl}phenol

SMILES

Oc(cccc1)c1-c1nc2ccccc2c(Nc2cccc(F)c2)n1

InChI

InChI=1S/C20H14FN3O/c21-13-6-5-7-14(12-13)22-19-15-8-1-3-10-17(15)23-20(24-19)16-9-2-4-11-18(16)25/h1-12,25H,(H,22,23,24)

InChI Key

MUBZHTSGAUKMLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00379008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.550

Distribution Coefficient, logD

5.517

Water Solubility, LogSw

-6.08

Polar Surface Area

44.353

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4229-0059 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Epigenetics Focused Set (26518 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with 4229-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4229-0059?
Check Price and Availability of 4229-0059, 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 4229-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4229-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4229-0059
  • 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 4229-0059 available by request