V022-0198 Screening compound: N-[3-AMINO-4-(2,3-DIFLUOROPHENYL)-2-PHENYL-2H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]-N-PHENETHYLAMINE

V022-0198 Screening compound: N-[3-AMINO-4-(2,3-DIFLUOROPHENYL)-2-PHENYL-2H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]-N-PHENETHYLAMINE
V022-0198 Screening compound: N-[3-AMINO-4-(2,3-DIFLUOROPHENYL)-2-PHENYL-2H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]-N-PHENETHYLAMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-0198
N-[3-AMINO-4-(2,3-DIFLUOROPHENYL)-2-PHENYL-2H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]-N-PHENETHYLAMINE

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

V022-0198

Molecular Formula

C25H20F2N6 (C25 H20 F2 N6)

Compound Name

N-[3-AMINO-4-(2,3-DIFLUOROPHENYL)-2-PHENYL-2H-PYRAZOLO[3,4-D]PYRIMIDIN-6-YL]-N-PHENETHYLAMINE

IUPAC name

4-(23-difluorophenyl)-2-phenyl-N6-(2-phenylethyl)-2H-pyrazolo[34-d]pyrimidine-36-diamine

SMILES

Nc1c2c(-c3cccc(F)c3F)nc(NCCc3ccccc3)nc2nn1-c1ccccc1

InChI

InChI=1S/C25H20F2N6/c26-19-13-7-12-18(21(19)27)22-20-23(28)33(17-10-5-2-6-11-17)32-24(20)31-25(30-22)29-15-14-16-8-3-1-4-9-16/h1-13H,14-15,28H2,(H,29,31,32)

InChI Key

XIEHWDKVOYUMDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14249790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.148

Distribution Coefficient, logD

5.148

Water Solubility, LogSw

-5.64

Polar Surface Area

64.652

Acid Dissociation Constant (pKa)

17.49

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

V022-0198 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 V022-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-0198?
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What is the minimum amount of V022-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-0198
  • 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 V022-0198 available by request