V020-2916 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

V020-2916 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
V020-2916 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-2916
4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-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

V020-2916

Molecular Formula

C25H26ClN7O2 (C25 H26 ClN7 O2)

Compound Name

4-(2H-1,3-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

IUPAC name

4-(2H-13-benzodioxol-5-yl)-2-(4-chlorophenyl)-N6-[2-(piperidin-1-yl)ethyl]-2H-pyrazolo[34-d]pyrimidine-36-diamine

SMILES

Nc1c2c(-c(cc3)cc4c3OCO4)nc(NCCN3CCCCC3)nc2nn1-c(cc1)ccc1Cl

InChI

InChI=1S/C25H26ClN7O2/c26-17-5-7-18(8-6-17)33-23(27)21-22(16-4-9-19-20(14-16)35-15-34-19)29-25(30-24(21)31-33)28-10-13-32-11-2-1-3-12-32/h4-9,14H,1-3,10-13,15,27H2,(H,28,30,31)

InChI Key

YCWWKOKIIAFDNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14249747

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

491.98

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.783

Distribution Coefficient, logD

2.985

Water Solubility, LogSw

-5.01

Polar Surface Area

85.750

Acid Dissociation Constant (pKa)

17.85

Base Dissociation Constant (pKb)

9.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

V020-2916 in Drug Discovery

Included in Screening Libraries

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

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V020-2916 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-2916?
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What is the minimum amount of V020-2916 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-2916
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-2916
  • 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 V020-2916 available by request