A0001329 Screening compound: 1-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

A0001329 Screening compound: 1-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine
A0001329 Screening compound: 1-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound A0001329
1-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

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

A0001329

Molecular Formula

C26H24F3N5O3 (C26 H24 F3 N5 O3)

Compound Name

1-[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

IUPAC name

1-[5-(34-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carbonyl]-4-phenylpiperazine

SMILES

COc(ccc(-c1nc2cc(C(N(CC3)CCN3c3ccccc3)=O)nn2c(C(F)(F)F)c1)c1)c1OC

InChI

InChI=1S/C26H24F3N5O3/c1-36-21-9-8-17(14-22(21)37-2)19-15-23(26(27,28)29)34-24(30-19)16-20(31-34)25(35)33-12-10-32(11-13-33)18-6-4-3-5-7-18/h3-9,14-16H,10-13H2,1-2H3

InChI Key

QKIVVSYNYQJKRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02087715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.405

Distribution Coefficient, logD

4.403

Water Solubility, LogSw

-4.43

Polar Surface Area

53.567

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

4.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

A0001329 in Drug Discovery

Included in Screening Libraries

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with A0001329 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound A0001329?
Check Price and Availability of A0001329, 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 A0001329 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for A0001329
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for A0001329
  • 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 A0001329 available by request