F365-0408 Screening compound: 7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione

F365-0408 Screening compound: 7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
F365-0408 Screening compound: 7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F365-0408
7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione

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

F365-0408

Molecular Formula

C24H24ClFN6O3 (C24 H24 ClFN6 O3)

Compound Name

7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione

IUPAC name

7-chloro-2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4-propyl-1H2H4H5H-[124]triazolo[43-a]quinazoline-15-dione

SMILES

CCCN(C(N1c(cc2)c3cc2Cl)=NN(CC(N(CC2)CCN2c(cc2)ccc2F)=O)C1=O)C3=O

InChI

InChI=1S/C24H24ClFN6O3/c1-2-9-30-22(34)19-14-16(25)3-8-20(19)32-23(30)27-31(24(32)35)15-21(33)29-12-10-28(11-13-29)18-6-4-17(26)5-7-18/h3-8,14H,2,9-13,15H2,1H3

InChI Key

QJMBZXLTYYKMOJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27119481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.94

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.438

Distribution Coefficient, logD

3.438

Water Solubility, LogSw

-3.81

Polar Surface Area

67.838

Acid Dissociation Constant (pKa)

19.28

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

F365-0408 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F365-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F365-0408?
Check Price and Availability of F365-0408, 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 F365-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F365-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F365-0408
  • 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 F365-0408 available by request