V001-4676 Screening compound: 4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

V001-4676 Screening compound: 4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
V001-4676 Screening compound: 4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-4676
4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

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

V001-4676

Molecular Formula

C23H23ClN6O (C23 H23 ClN6 O)

Compound Name

4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

IUPAC name

4-(4-chlorophenyl)-2-(3-methylphenyl)-N6-[(oxolan-2-yl)methyl]-2H-pyrazolo[34-d]pyrimidine-36-diamine

SMILES

Cc1cccc(-n(c(N)c23)nc3nc(NCC3OCCC3)nc2-c(cc2)ccc2Cl)c1

InChI

InChI=1S/C23H23ClN6O/c1-14-4-2-5-17(12-14)30-21(25)19-20(15-7-9-16(24)10-8-15)27-23(28-22(19)29-30)26-13-18-6-3-11-31-18/h2,4-5,7-10,12,18H,3,6,11,13,25H2,1H3,(H,26,28,29)/t18-/m1/s1

InChI Key

HYZRFZKYPGKWDV-GOSISDBHSA-N

MDL Number (MFCD)

MFCD14248713

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

434.93

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.730

Distribution Coefficient, logD

4.730

Water Solubility, LogSw

-4.90

Polar Surface Area

73.465

Acid Dissociation Constant (pKa)

18.25

Base Dissociation Constant (pKb)

3.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

V001-4676 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V001-4676 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-4676?
Check Price and Availability of V001-4676, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V001-4676 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-4676
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-4676
  • 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 V001-4676 available by request