C202-3720 Screening compound: (5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline

C202-3720 Screening compound: (5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline
C202-3720 Screening compound: (5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-3720
(5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline

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

C202-3720

Molecular Formula

C22H18F2N4 (C22 H18 F2 N4)

Compound Name

(5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline

IUPAC name

(5E)-9-(4-fluorophenyl)-5-[(4-fluorophenyl)methylidene]-4H5H6H7H8H9H-[124]triazolo[32-b]quinazoline

SMILES

Fc1ccc(C2n3ncnc3NC3=C2CCC/C3=C\c(cc2)ccc2F)cc1

InChI

InChI=1S/C22H18F2N4/c23-17-8-4-14(5-9-17)12-16-2-1-3-19-20(16)27-22-25-13-26-28(22)21(19)15-6-10-18(24)11-7-15/h4-13,21H,1-3H2,(H,25,26,27)/t21-/m0/s1

InChI Key

QLQTYYJYZIXFON-NRFANRHFSA-N

MDL Number (MFCD)

MFCD00564728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.41

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.789

Distribution Coefficient, logD

4.789

Water Solubility, LogSw

-4.90

Polar Surface Area

38.196

Acid Dissociation Constant (pKa)

13.36

Base Dissociation Constant (pKb)

-1.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.20

C202-3720 in Drug Discovery

Included in Screening Libraries

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

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C202-3720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-3720?
Check Price and Availability of C202-3720, 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 C202-3720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-3720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-3720
  • 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 C202-3720 available by request