V026-2107 Screening compound: 1-cyclopentanecarbonyl-4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

V026-2107 Screening compound: 1-cyclopentanecarbonyl-4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane
V026-2107 Screening compound: 1-cyclopentanecarbonyl-4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-2107
1-cyclopentanecarbonyl-4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

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

V026-2107

Molecular Formula

C25H32N6O (C25 H32 N6 O)

Compound Name

1-cyclopentanecarbonyl-4-[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepane

IUPAC name

1-cyclopentanecarbonyl-4-[1-(24-dimethylphenyl)-6-methyl-1H-pyrazolo[34-d]pyrimidin-4-yl]-14-diazepane

SMILES

Cc(cc1)cc(C)c1-n1ncc2c1nc(C)nc2N(CCC1)CCN1C(C1CCCC1)=O

InChI

InChI=1S/C25H32N6O/c1-17-9-10-22(18(2)15-17)31-24-21(16-26-31)23(27-19(3)28-24)29-11-6-12-30(14-13-29)25(32)20-7-4-5-8-20/h9-10,15-16,20H,4-8,11-14H2,1-3H3

InChI Key

SPTGTSOFIMERKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14260202

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

432.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.349

Distribution Coefficient, logD

5.240

Water Solubility, LogSw

-5.26

Polar Surface Area

53.279

Acid Dissociation Constant (pKa)

21.73

Base Dissociation Constant (pKb)

6.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.00

V026-2107 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V026-2107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-2107?
Check Price and Availability of V026-2107, 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 V026-2107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-2107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-2107
  • 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 V026-2107 available by request