A0013198 Screening compound: 1-[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]-4-phenylpiperazine

A0013198 Screening compound: 1-[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]-4-phenylpiperazine
A0013198 Screening compound: 1-[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound A0013198
1-[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-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

A0013198

Molecular Formula

C25H22F3N5O (C25 H22 F3 N5 O)

Compound Name

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

IUPAC name

1-[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-3-carbonyl]-4-phenylpiperazine

SMILES

Cc(cc1)ccc1-c(cc(C(F)(F)F)n1nc2)nc1c2C(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C25H22F3N5O/c1-17-7-9-18(10-8-17)21-15-22(25(26,27)28)33-23(30-21)20(16-29-33)24(34)32-13-11-31(12-14-32)19-5-3-2-4-6-19/h2-10,15-16H,11-14H2,1H3

InChI Key

NWGFSPRLFCACAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01529336

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

5.155

Water Solubility, LogSw

-4.87

Polar Surface Area

39.076

Acid Dissociation Constant (pKa)

27.18

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with A0013198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound A0013198?
Check Price and Availability of A0013198, 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 A0013198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for A0013198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for A0013198
  • 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 A0013198 available by request