F366-0094 Screening compound: 2-{1,5-dioxo-4-[3-(propan-2-yloxy)propyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl}acetonitrile

F366-0094 Screening compound: 2-{1,5-dioxo-4-[3-(propan-2-yloxy)propyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl}acetonitrile
F366-0094 Screening compound: 2-{1,5-dioxo-4-[3-(propan-2-yloxy)propyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl}acetonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound F366-0094
2-{1,5-dioxo-4-[3-(propan-2-yloxy)propyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl}acetonitrile

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

F366-0094

Molecular Formula

C17H19N5O3 (C17 H19 N5 O3)

Compound Name

2-{1,5-dioxo-4-[3-(propan-2-yloxy)propyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl}acetonitrile

IUPAC name

2-{15-dioxo-4-[3-(propan-2-yloxy)propyl]-1H2H4H5H-[124]triazolo[43-a]quinazolin-2-yl}acetonitrile

SMILES

CC(C)OCCCN(C(N1c2c3cccc2)=NN(CC#N)C1=O)C3=O

InChI

InChI=1S/C17H19N5O3/c1-12(2)25-11-5-9-20-15(23)13-6-3-4-7-14(13)22-16(20)19-21(10-8-18)17(22)24/h3-4,6-7,12H,5,9-11H2,1-2H3

InChI Key

CEJJODVNXBHBQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27119559

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.116

Distribution Coefficient, logD

1.116

Water Solubility, LogSw

-2.31

Polar Surface Area

73.128

Acid Dissociation Constant (pKa)

19.36

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

F366-0094 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F366-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F366-0094?
Check Price and Availability of F366-0094, 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 F366-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F366-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F366-0094
  • 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 F366-0094 available by request