C736-0122 Screening compound: 1-(4-fluorophenyl)-4-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}piperazine

C736-0122 Screening compound: 1-(4-fluorophenyl)-4-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}piperazine
C736-0122 Screening compound: 1-(4-fluorophenyl)-4-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C736-0122
1-(4-fluorophenyl)-4-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}piperazine

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

C736-0122

Molecular Formula

C25H21FN6 (C25 H21 FN6)

Compound Name

1-(4-fluorophenyl)-4-{2-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}piperazine

IUPAC name

1-(4-fluorophenyl)-4-{2-phenyl-[124]triazolo[15-c]quinazolin-5-yl}piperazine

SMILES

Fc(cc1)ccc1N(CC1)CCN1c1nc(cccc2)c2c2nc(-c3ccccc3)nn12

InChI

InChI=1S/C25H21FN6/c26-19-10-12-20(13-11-19)30-14-16-31(17-15-30)25-27-22-9-5-4-8-21(22)24-28-23(29-32(24)25)18-6-2-1-3-7-18/h1-13H,14-17H2

InChI Key

IOYVLVZZNHLZKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14789870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.484

Distribution Coefficient, logD

4.889

Water Solubility, LogSw

-6.30

Polar Surface Area

35.740

Acid Dissociation Constant (pKa)

22.00

Base Dissociation Constant (pKb)

7.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

C736-0122 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C736-0122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C736-0122?
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What is the minimum amount of C736-0122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C736-0122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C736-0122
  • 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 C736-0122 available by request