V024-1421 Screening compound: 3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V024-1421 Screening compound: 3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V024-1421 Screening compound: 3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-1421
3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione

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

V024-1421

Molecular Formula

C24H20F4N4O3 (C24 H20 F4 N4 O3)

Compound Name

3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-(4-fluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[3-(trifluoromethyl)phenyl]methyl}-2367-tetrahydro-1H-purine-26-dione

SMILES

O=C(c1c(N2c(cc3)ccc3F)ncn1Cc1cc(C(F)(F)F)ccc1)N(CC1OCCC1)C2=O

InChI

InChI=1S/C24H20F4N4O3/c25-17-6-8-18(9-7-17)32-21-20(22(33)31(23(32)34)13-19-5-2-10-35-19)30(14-29-21)12-15-3-1-4-16(11-15)24(26,27)28/h1,3-4,6-9,11,14,19H,2,5,10,12-13H2/t19-/m1/s1

InChI Key

DCLKPESVTTYKJD-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19920926

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

488.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.180

Distribution Coefficient, logD

3.180

Water Solubility, LogSw

-3.20

Polar Surface Area

50.929

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

V024-1421 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V024-1421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-1421?
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What is the minimum amount of V024-1421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-1421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-1421
  • 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 V024-1421 available by request