V023-4085 Screening compound: N-[3-amino-2-(2,5-difluorophenyl)-4-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-N-tetrahydro-2-furanylmethylamine

V023-4085 Screening compound: N-[3-amino-2-(2,5-difluorophenyl)-4-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-N-tetrahydro-2-furanylmethylamine
V023-4085 Screening compound: N-[3-amino-2-(2,5-difluorophenyl)-4-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-N-tetrahydro-2-furanylmethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-4085
N-[3-amino-2-(2,5-difluorophenyl)-4-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-N-tetrahydro-2-furanylmethylamine

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

V023-4085

Molecular Formula

C23H22F2N6O (C23 H22 F2 N6 O)

Compound Name

N-[3-amino-2-(2,5-difluorophenyl)-4-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]-N-tetrahydro-2-furanylmethylamine

IUPAC name

n/a

SMILES

Cc1cccc(-c(c2c3N)nc(NCC4OCCC4)nc2nn3-c(cc(cc2)F)c2F)c1

InChI

InChI=1S/C23H22F2N6O/c1-13-4-2-5-14(10-13)20-19-21(26)31(18-11-15(24)7-8-17(18)25)30-22(19)29-23(28-20)27-12-16-6-3-9-32-16/h2,4-5,7-8,10-11,16H,3,6,9,12,26H2,1H3,(H,27,29,30)/t16-/m1/s1

InChI Key

RCCCSRPMWYGDLZ-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD14250195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.284

Distribution Coefficient, logD

4.284

Water Solubility, LogSw

-4.70

Polar Surface Area

73.164

Acid Dissociation Constant (pKa)

18.25

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

V023-4085 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 V023-4085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-4085?
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What is the minimum amount of V023-4085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-4085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-4085
  • 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 V023-4085 available by request