V023-4168 Screening compound: N6-CYCLOPROPYL-2-(2,5-DIFLUOROPHENYL)-4-(3-METHYLPHENYL)-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE

V023-4168 Screening compound: N6-CYCLOPROPYL-2-(2,5-DIFLUOROPHENYL)-4-(3-METHYLPHENYL)-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE
V023-4168 Screening compound: N6-CYCLOPROPYL-2-(2,5-DIFLUOROPHENYL)-4-(3-METHYLPHENYL)-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-4168
N6-CYCLOPROPYL-2-(2,5-DIFLUOROPHENYL)-4-(3-METHYLPHENYL)-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE

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

V023-4168

Molecular Formula

C21H18F2N6 (C21 H18 F2 N6)

Compound Name

N6-CYCLOPROPYL-2-(2,5-DIFLUOROPHENYL)-4-(3-METHYLPHENYL)-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE

IUPAC name

n/a

SMILES

Cc1cccc(-c(c2c3N)nc(NC4CC4)nc2nn3-c(cc(cc2)F)c2F)c1

InChI

InChI=1S/C21H18F2N6/c1-11-3-2-4-12(9-11)18-17-19(24)29(16-10-13(22)5-8-15(16)23)28-20(17)27-21(26-18)25-14-6-7-14/h2-5,8-10,14H,6-7,24H2,1H3,(H,25,27,28)

InChI Key

NAHTXVMMHVMQKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14250190

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.531

Distribution Coefficient, logD

4.531

Water Solubility, LogSw

-4.69

Polar Surface Area

64.566

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

V023-4168 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V023-4168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-4168?
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What is the minimum amount of V023-4168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-4168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-4168
  • 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 V023-4168 available by request