6711-0072 Screening compound: 1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

6711-0072 Screening compound: 1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine
6711-0072 Screening compound: 1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6711-0072
1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-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

6711-0072

Molecular Formula

C27H19ClF3N3 (C27 H19 ClF3 N3)

Compound Name

1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine

IUPAC name

1-benzyl-3-(4-chlorophenyl)-6-(4-methylphenyl)-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridine

SMILES

Cc(cc1)ccc1-c1cc(C(F)(F)F)c(c(-c(cc2)ccc2Cl)nn2Cc3ccccc3)c2n1

InChI

InChI=1S/C27H19ClF3N3/c1-17-7-9-19(10-8-17)23-15-22(27(29,30)31)24-25(20-11-13-21(28)14-12-20)33-34(26(24)32-23)16-18-5-3-2-4-6-18/h2-15H,16H2,1H3

InChI Key

UTAQVYOXIRCTCK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.92

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.155

Distribution Coefficient, logD

8.155

Water Solubility, LogSw

-6.69

Polar Surface Area

23.148

Acid Dissociation Constant (pKa)

25.47

Base Dissociation Constant (pKb)

3.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 6711-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6711-0072?
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What is the minimum amount of 6711-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6711-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6711-0072
  • 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 6711-0072 available by request