V028-2287 Screening compound: N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-2-fluorobenzamide

V028-2287 Screening compound: N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-2-fluorobenzamide
V028-2287 Screening compound: N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-2-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-2287
N-(4-{[1-(3-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-2-fluorobenzamide

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

V028-2287

Molecular Formula

C27H28ClFN6O (C27 H28 ClFN6 O)

Compound Name

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

IUPAC name

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

SMILES

CC(C)c1nc(NC(CC2)CCC2NC(c(cccc2)c2F)=O)c(cnn2-c3cccc(Cl)c3)c2n1

InChI

InChI=1S/C27H28ClFN6O/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

MJKDVCIWRVCYOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19813738

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

507.01

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

6.306

Distribution Coefficient, logD

6.291

Water Solubility, LogSw

-6.18

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

V028-2287 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system

References: we are preparing a list of scientific research reports with V028-2287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-2287?
Check Price and Availability of V028-2287, 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 V028-2287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-2287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-2287
  • 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 V028-2287 available by request