8586-0052 Screening compound: 1-(4-fluorobenzoyl)-1H,2H,3H,4H,6H-pyrimido[2,1-b]quinazolin-6-one

8586-0052 Screening compound: 1-(4-fluorobenzoyl)-1H,2H,3H,4H,6H-pyrimido[2,1-b]quinazolin-6-one
8586-0052 Screening compound: 1-(4-fluorobenzoyl)-1H,2H,3H,4H,6H-pyrimido[2,1-b]quinazolin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8586-0052
1-(4-fluorobenzoyl)-1H,2H,3H,4H,6H-pyrimido[2,1-b]quinazolin-6-one

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

8586-0052

Molecular Formula

C18H14FN3O2 (C18 H14 FN3 O2)

Compound Name

1-(4-fluorobenzoyl)-1H,2H,3H,4H,6H-pyrimido[2,1-b]quinazolin-6-one

IUPAC name

1-(4-fluorobenzoyl)-1H2H3H4H6H-pyrimido[21-b]quinazolin-6-one

SMILES

O=C(c(cc1)ccc1F)N(CCCN12)C1=Nc(cccc1)c1C2=O

InChI

InChI=1S/C18H14FN3O2/c19-13-8-6-12(7-9-13)16(23)21-10-3-11-22-17(24)14-4-1-2-5-15(14)20-18(21)22/h1-2,4-9H,3,10-11H2

InChI Key

UPKDLVSQMCCVIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09039858

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.015

Distribution Coefficient, logD

2.015

Water Solubility, LogSw

-2.57

Polar Surface Area

42.675

Acid Dissociation Constant (pKa)

27.65

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 8586-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8586-0052?
Check Price and Availability of 8586-0052, 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 8586-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8586-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8586-0052
  • 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 8586-0052 available by request