V025-0718 Screening compound: 1-{4-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}-3-methylbutan-1-one

V025-0718 Screening compound: 1-{4-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}-3-methylbutan-1-one
V025-0718 Screening compound: 1-{4-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}-3-methylbutan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-0718
1-{4-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}-3-methylbutan-1-one

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

V025-0718

Molecular Formula

C24H32N6O (C24 H32 N6 O)

Compound Name

1-{4-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}-3-methylbutan-1-one

IUPAC name

1-{4-[36-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]-14-diazepan-1-yl}-3-methylbutan-1-one

SMILES

CC(C)CC(N(CCC1)CCN1c1nc(C)nc2c1c(C)nn2-c1ccc(C)cc1)=O

InChI

InChI=1S/C24H32N6O/c1-16(2)15-21(31)28-11-6-12-29(14-13-28)23-22-18(4)27-30(24(22)26-19(5)25-23)20-9-7-17(3)8-10-20/h7-10,16H,6,11-15H2,1-5H3

InChI Key

DRTNOQYODNHSKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14259745

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.205

Distribution Coefficient, logD

3.886

Water Solubility, LogSw

-4.35

Polar Surface Area

53.119

Acid Dissociation Constant (pKa)

21.73

Base Dissociation Constant (pKb)

7.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

V025-0718 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 V025-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-0718?
Check Price and Availability of V025-0718, 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 V025-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-0718
  • 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 V025-0718 available by request