V024-1318 Screening compound: 3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V024-1318 Screening compound: 3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V024-1318 Screening compound: 3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-1318
3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-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

V024-1318

Molecular Formula

C21H15F3N4O2 (C21 H15 F3 N4 O2)

Compound Name

3-(2,4-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-(24-difluorophenyl)-7-[(3-fluorophenyl)methyl]-1-(prop-2-en-1-yl)-2367-tetrahydro-1H-purine-26-dione

SMILES

C=CCN(C(c1c(N2c(ccc(F)c3)c3F)ncn1Cc1cc(F)ccc1)=O)C2=O

InChI

InChI=1S/C21H15F3N4O2/c1-2-8-27-20(29)18-19(25-12-26(18)11-13-4-3-5-14(22)9-13)28(21(27)30)17-7-6-15(23)10-16(17)24/h2-7,9-10,12H,1,8,11H2

InChI Key

JWJZQJQDHDVZMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19904876

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

412.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.011

Distribution Coefficient, logD

3.011

Water Solubility, LogSw

-3.24

Polar Surface Area

42.223

Acid Dissociation Constant (pKa)

21.75

Base Dissociation Constant (pKb)

0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with V024-1318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-1318?
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What is the minimum amount of V024-1318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-1318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-1318
  • 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 V024-1318 available by request