7590-1117 Screening compound: 6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

7590-1117 Screening compound: 6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
7590-1117 Screening compound: 6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7590-1117
6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

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

7590-1117

Molecular Formula

C20H13BrF3N3 (C20 H13 BrF3 N3)

Compound Name

6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

IUPAC name

6-(3-bromophenyl)-3-methyl-1-phenyl-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridine

SMILES

Cc(c(c(C(F)(F)F)c1)c2nc1-c1cccc(Br)c1)nn2-c1ccccc1

InChI

InChI=1S/C20H13BrF3N3/c1-12-18-16(20(22,23)24)11-17(13-6-5-7-14(21)10-13)25-19(18)27(26-12)15-8-3-2-4-9-15/h2-11H,1H3

InChI Key

YGMDRRDUACARBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06135718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.24

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.374

Distribution Coefficient, logD

6.374

Water Solubility, LogSw

-6.42

Polar Surface Area

23.363

Acid Dissociation Constant (pKa)

30.73

Base Dissociation Constant (pKb)

3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 7590-1117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7590-1117?
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What is the minimum amount of 7590-1117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7590-1117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7590-1117
  • 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 7590-1117 available by request