D245-0009 Screening compound: 1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperazine

D245-0009 Screening compound: 1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperazine
D245-0009 Screening compound: 1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0009
1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-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

D245-0009

Molecular Formula

C22H21FN6 (C22 H21 FN6)

Compound Name

1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}piperazine

IUPAC name

1-(4-fluorophenyl)-4-{5-methyl-2-phenyl-[124]triazolo[15-a]pyrimidin-7-yl}piperazine

SMILES

Cc1nc2nc(-c3ccccc3)nn2c(N(CC2)CCN2c(cc2)ccc2F)c1

InChI

InChI=1S/C22H21FN6/c1-16-15-20(28-13-11-27(12-14-28)19-9-7-18(23)8-10-19)29-22(24-16)25-21(26-29)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3

InChI Key

KSOLQSQUJLDTMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.45

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

4.488

Distribution Coefficient, logD

4.264

Water Solubility, LogSw

-4.33

Polar Surface Area

36.377

Acid Dissociation Constant (pKa)

24.61

Base Dissociation Constant (pKb)

7.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

D245-0009 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D245-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0009?
Check Price and Availability of D245-0009, 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 D245-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0009
  • 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 D245-0009 available by request