V023-3528 Screening compound: 1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V023-3528 Screening compound: 1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V023-3528 Screening compound: 1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-3528
1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)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

V023-3528

Molecular Formula

C24H23FN4O2 (C24 H23 FN4 O2)

Compound Name

1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

1-cyclopentyl-3-(3-fluorophenyl)-7-[(4-methylphenyl)methyl]-2367-tetrahydro-1H-purine-26-dione

SMILES

Cc1ccc(Cn2c(C(N(C3CCCC3)C(N3c4cccc(F)c4)=O)=O)c3nc2)cc1

InChI

InChI=1S/C24H23FN4O2/c1-16-9-11-17(12-10-16)14-27-15-26-22-21(27)23(30)29(19-6-2-3-7-19)24(31)28(22)20-8-4-5-18(25)13-20/h4-5,8-13,15,19H,2-3,6-7,14H2,1H3

InChI Key

BJVZHLQIWLHTIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19919980

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

418.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.896

Distribution Coefficient, logD

3.896

Water Solubility, LogSw

-3.87

Polar Surface Area

41.862

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

-1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with V023-3528 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of V023-3528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-3528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-3528
  • 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 V023-3528 available by request