Y043-1903 Screening compound: 6-fluoro-3-[4-(trifluoromethoxy)benzyl]-4(3H)-quinazolinone

Y043-1903 Screening compound: 6-fluoro-3-[4-(trifluoromethoxy)benzyl]-4(3H)-quinazolinone
Y043-1903 Screening compound: 6-fluoro-3-[4-(trifluoromethoxy)benzyl]-4(3H)-quinazolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-1903
6-fluoro-3-[4-(trifluoromethoxy)benzyl]-4(3H)-quinazolinone

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

Y043-1903

Molecular Formula

C16H10F4N2O2 (C16 H10 F4 N2 O2)

Compound Name

6-fluoro-3-[4-(trifluoromethoxy)benzyl]-4(3H)-quinazolinone

IUPAC name

6-fluoro-3-{[4-(trifluoromethoxy)phenyl]methyl}-34-dihydroquinazolin-4-one

SMILES

O=C1N(Cc(cc2)ccc2OC(F)(F)F)C=Nc(cc2)c1cc2F

InChI

InChI=1S/C16H10F4N2O2/c17-11-3-6-14-13(7-11)15(23)22(9-21-14)8-10-1-4-12(5-2-10)24-16(18,19)20/h1-7,9H,8H2

InChI Key

ILTJDRBRGYIRIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18797569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.611

Distribution Coefficient, logD

3.611

Water Solubility, LogSw

-3.88

Polar Surface Area

32.276

Acid Dissociation Constant (pKa)

30.88

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

Y043-1903 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with Y043-1903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-1903?
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What is the minimum amount of Y043-1903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-1903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-1903
  • 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 Y043-1903 available by request