G869-0158 Screening compound: N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide

G869-0158 Screening compound: N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide
G869-0158 Screening compound: N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G869-0158
N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide

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

G869-0158

Molecular Formula

C26H25N5O (C26 H25 N5 O)

Compound Name

N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide

IUPAC name

N-(4-{[4-methyl-6-(phenylamino)pyrimidin-2-yl]amino}phenyl)-3-phenylpropanamide

SMILES

Cc1nc(Nc(cc2)ccc2NC(CCc2ccccc2)=O)nc(Nc2ccccc2)c1

InChI

InChI=1S/C26H25N5O/c1-19-18-24(28-21-10-6-3-7-11-21)31-26(27-19)30-23-15-13-22(14-16-23)29-25(32)17-12-20-8-4-2-5-9-20/h2-11,13-16,18H,12,17H2,1H3,(H,29,32)(H2,27,28,30,31)

InChI Key

XYGXCYKIFTVOHG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09238319

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.698

Distribution Coefficient, logD

4.849

Water Solubility, LogSw

-5.42

Polar Surface Area

61.020

Acid Dissociation Constant (pKa)

12.22

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

G869-0158 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G869-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G869-0158?
Check Price and Availability of G869-0158, 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 G869-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G869-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G869-0158
  • 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 G869-0158 available by request