V024-3487 Screening compound: 7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V024-3487 Screening compound: 7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V024-3487 Screening compound: 7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-3487
7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-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

V024-3487

Molecular Formula

C27H24N4O2 (C27 H24 N4 O2)

Compound Name

7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

7-[(3-methylphenyl)methyl]-3-phenyl-1-(2-phenylethyl)-2367-tetrahydro-1H-purine-26-dione

SMILES

Cc1cccc(Cn2c(C(N(CCc3ccccc3)C(N3c4ccccc4)=O)=O)c3nc2)c1

InChI

InChI=1S/C27H24N4O2/c1-20-9-8-12-22(17-20)18-29-19-28-25-24(29)26(32)30(16-15-21-10-4-2-5-11-21)27(33)31(25)23-13-6-3-7-14-23/h2-14,17,19H,15-16,18H2,1H3

InChI Key

YHEDFJFKBDPCDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19919864

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

436.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.632

Distribution Coefficient, logD

4.632

Water Solubility, LogSw

-4.49

Polar Surface Area

42.253

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

V024-3487 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V024-3487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-3487?
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What is the minimum amount of V024-3487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-3487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-3487
  • 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 V024-3487 available by request