V024-0166 Screening compound: 3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

V024-0166 Screening compound: 3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
V024-0166 Screening compound: 3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-0166
3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-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

V024-0166

Molecular Formula

C23H21Cl3N4O2 (C23 H21 Cl3 N4 O2)

Compound Name

3-(2-chlorophenyl)-7-[(3,4-dichlorophenyl)methyl]-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-(2-chlorophenyl)-7-[(34-dichlorophenyl)methyl]-1-(3-methylbutyl)-2367-tetrahydro-1H-purine-26-dione

SMILES

CC(C)CCN(C(c1c(N2c(cccc3)c3Cl)ncn1Cc(cc1)cc(Cl)c1Cl)=O)C2=O

InChI

InChI=1S/C23H21Cl3N4O2/c1-14(2)9-10-29-22(31)20-21(30(23(29)32)19-6-4-3-5-17(19)25)27-13-28(20)12-15-7-8-16(24)18(26)11-15/h3-8,11,13-14H,9-10,12H2,1-2H3

InChI Key

NRPPRUCITYLBDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19921420

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

491.8

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

5.790

Distribution Coefficient, logD

5.790

Water Solubility, LogSw

-5.92

Polar Surface Area

42.223

Acid Dissociation Constant (pKa)

21.29

Base Dissociation Constant (pKb)

-0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

V024-0166 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 V024-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-0166?
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What is the minimum amount of V024-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-0166
  • 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 V024-0166 available by request