V026-9645 Screening compound: 1-{4-[6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]-1,4-DIAZEPAN-1-YL}-2-METHOXYETHAN-1-ONE

V026-9645 Screening compound: 1-{4-[6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]-1,4-DIAZEPAN-1-YL}-2-METHOXYETHAN-1-ONE
V026-9645 Screening compound: 1-{4-[6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]-1,4-DIAZEPAN-1-YL}-2-METHOXYETHAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-9645
1-{4-[6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]-1,4-DIAZEPAN-1-YL}-2-METHOXYETHAN-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

V026-9645

Molecular Formula

C24H30N6O3 (C24 H30 N6 O3)

Compound Name

1-{4-[6-CYCLOPROPYL-1-(4-METHOXYPHENYL)-3-METHYL-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]-1,4-DIAZEPAN-1-YL}-2-METHOXYETHAN-1-ONE

IUPAC name

1-{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[34-d]pyrimidin-4-yl]-14-diazepan-1-yl}-2-methoxyethan-1-one

SMILES

Cc(c1c2nc(C3CC3)nc1N(CCC1)CCN1C(COC)=O)nn2-c(cc1)ccc1OC

InChI

InChI=1S/C24H30N6O3/c1-16-21-23(29-12-4-11-28(13-14-29)20(31)15-32-2)25-22(17-5-6-17)26-24(21)30(27-16)18-7-9-19(33-3)10-8-18/h7-10,17H,4-6,11-15H2,1-3H3

InChI Key

FKKHNQVNMVUESA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14256334

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.838

Distribution Coefficient, logD

1.201

Water Solubility, LogSw

-3.26

Polar Surface Area

69.726

Acid Dissociation Constant (pKa)

21.73

Base Dissociation Constant (pKb)

9.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V026-9645 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-9645?
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What is the minimum amount of V026-9645 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-9645
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-9645
  • 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 V026-9645 available by request