K061-0937 Screening compound: 1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-1,2,3,4-tetrahydroquinoline

K061-0937 Screening compound: 1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-1,2,3,4-tetrahydroquinoline
K061-0937 Screening compound: 1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-1,2,3,4-tetrahydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound K061-0937
1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-1,2,3,4-tetrahydroquinoline

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

K061-0937

Molecular Formula

C23H15Br2F3N4O (C23 H15 Br2 F3 N4 O)

Compound Name

1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]-1,2,3,4-tetrahydroquinoline

IUPAC name

1-[3-bromo-5-(4-bromophenyl)-7-(trifluoromethyl)pyrazolo[15-a]pyrimidine-2-carbonyl]-1234-tetrahydroquinoline

SMILES

O=C(c1nn2c(C(F)(F)F)cc(-c(cc3)ccc3Br)nc2c1Br)N(CCC1)c2c1cccc2

InChI

InChI=1S/C23H15Br2F3N4O/c24-15-9-7-13(8-10-15)16-12-18(23(26,27)28)32-21(29-16)19(25)20(30-32)22(33)31-11-3-5-14-4-1-2-6-17(14)31/h1-2,4,6-10,12H,3,5,11H2

InChI Key

XAELQNUMAJDVBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01451920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

580.2

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.905

Distribution Coefficient, logD

6.905

Water Solubility, LogSw

-6.22

Polar Surface Area

35.027

Acid Dissociation Constant (pKa)

25.58

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with K061-0937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K061-0937?
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What is the minimum amount of K061-0937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K061-0937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K061-0937
  • 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 K061-0937 available by request