V026-1995 Screening compound: 2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide

V026-1995 Screening compound: 2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
V026-1995 Screening compound: 2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-1995
2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide

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

V026-1995

Molecular Formula

C27H28Cl2N6O (C27 H28 Cl2 N6 O)

Compound Name

2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide

IUPAC name

2-chloro-N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[34-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide

SMILES

CC(C)c1nc(n(-c2cc(Cl)ccc2)nc2)c2c(NC(CC2)CCC2NC(c(cccc2)c2Cl)=O)n1

InChI

InChI=1S/C27H28Cl2N6O/c1-16(2)24-33-25(22-15-30-35(26(22)34-24)20-7-5-6-17(28)14-20)31-18-10-12-19(13-11-18)32-27(36)21-8-3-4-9-23(21)29/h3-9,14-16,18-19H,10-13H2,1-2H3,(H,32,36)(H,31,33,34)

InChI Key

NGOMBGMRHDOWKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14254519

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

523.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.778

Distribution Coefficient, logD

6.763

Water Solubility, LogSw

-6.24

Polar Surface Area

67.783

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

V026-1995 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 V026-1995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-1995?
Check Price and Availability of V026-1995, 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 V026-1995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-1995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-1995
  • 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 V026-1995 available by request