G868-0960 Screening compound: N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide

G868-0960 Screening compound: N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide
G868-0960 Screening compound: N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G868-0960
N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide

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

G868-0960

Molecular Formula

C22H23ClN6O (C22 H23 ClN6 O)

Compound Name

N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide

IUPAC name

N-(3-chlorophenyl)-4-[4-methyl-6-(phenylamino)pyrimidin-2-yl]piperazine-1-carboxamide

SMILES

Cc1nc(N(CC2)CCN2C(Nc2cccc(Cl)c2)=O)nc(Nc2ccccc2)c1

InChI

InChI=1S/C22H23ClN6O/c1-16-14-20(25-18-7-3-2-4-8-18)27-21(24-16)28-10-12-29(13-11-28)22(30)26-19-9-5-6-17(23)15-19/h2-9,14-15H,10-13H2,1H3,(H,26,30)(H,24,25,27)

InChI Key

WDHDBOWSCLKCSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09237994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.92

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.034

Distribution Coefficient, logD

4.459

Water Solubility, LogSw

-5.03

Polar Surface Area

55.752

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

7.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

G868-0960 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

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

CNS Targets (44014 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with G868-0960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G868-0960?
Check Price and Availability of G868-0960, 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 G868-0960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G868-0960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G868-0960
  • 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 G868-0960 available by request