K061-0866 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(2,3-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

K061-0866 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(2,3-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
K061-0866 Screening compound: 5-(4-bromophenyl)-3-chloro-N-(2,3-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K061-0866
5-(4-bromophenyl)-3-chloro-N-(2,3-dichlorophenyl)-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

K061-0866

Molecular Formula

C20H9BrCl3F3N4O (C20 H9 BrCl3 F3 N4 O)

Compound Name

5-(4-bromophenyl)-3-chloro-N-(2,3-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

IUPAC name

5-(4-bromophenyl)-3-chloro-N-(23-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carboxamide

SMILES

O=C(c1nn2c(C(F)(F)F)cc(-c(cc3)ccc3Br)nc2c1Cl)Nc(cccc1Cl)c1Cl

InChI

InChI=1S/C20H9BrCl3F3N4O/c21-10-6-4-9(5-7-10)13-8-14(20(25,26)27)31-18(28-13)16(24)17(30-31)19(32)29-12-3-1-2-11(22)15(12)23/h1-8H,(H,29,32)

InChI Key

IIGIYVCTUQUQEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01528382

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

564.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.613

Distribution Coefficient, logD

7.357

Water Solubility, LogSw

-7.00

Polar Surface Area

42.108

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with K061-0866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K061-0866?
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What is the minimum amount of K061-0866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K061-0866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K061-0866
  • 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 K061-0866 available by request