K061-0899 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

K061-0899 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
K061-0899 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K061-0899
5-(4-bromophenyl)-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

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

K061-0899

Molecular Formula

C25H17BrClF3N6O2 (C25 H17 BrClF3 N6 O2)

Compound Name

5-(4-bromophenyl)-3-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

5-(4-bromophenyl)-3-chloro-N-(15-dimethyl-3-oxo-2-phenyl-23-dihydro-1H-pyrazol-4-yl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

CC(N(C)N(C1=O)c2ccccc2)=C1NC(c1nn2c(C(F)(F)F)cc(-c(cc3)ccc3Br)nc2c1Cl)=O

InChI

InChI=1S/C25H17BrClF3N6O2/c1-13-20(24(38)36(34(13)2)16-6-4-3-5-7-16)32-23(37)21-19(27)22-31-17(14-8-10-15(26)11-9-14)12-18(25(28,29)30)35(22)33-21/h3-12H,1-2H3,(H,32,37)

InChI Key

CKBSTDGPTNKJEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01528409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

605.8

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.995

Distribution Coefficient, logD

4.399

Water Solubility, LogSw

-5.33

Polar Surface Area

63.187

Acid Dissociation Constant (pKa)

6.93

Base Dissociation Constant (pKb)

0.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

K061-0899 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K061-0899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K061-0899?
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What is the minimum amount of K061-0899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K061-0899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K061-0899
  • 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 K061-0899 available by request