C095-0440 Screening compound: 2-(2-CHLORO-6-FLUOROPHENYL)-N-{4-METHYL-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]QUINOLIN-6-YL}ACETAMIDE

C095-0440 Screening compound: 2-(2-CHLORO-6-FLUOROPHENYL)-N-{4-METHYL-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]QUINOLIN-6-YL}ACETAMIDE
C095-0440 Screening compound: 2-(2-CHLORO-6-FLUOROPHENYL)-N-{4-METHYL-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]QUINOLIN-6-YL}ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0440
2-(2-CHLORO-6-FLUOROPHENYL)-N-{4-METHYL-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]QUINOLIN-6-YL}ACETAMIDE

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

C095-0440

Molecular Formula

C26H24ClFN6O (C26 H24 ClFN6 O)

Compound Name

2-(2-CHLORO-6-FLUOROPHENYL)-N-{4-METHYL-2-[4-(PYRIMIDIN-2-YL)PIPERAZIN-1-YL]QUINOLIN-6-YL}ACETAMIDE

IUPAC name

n/a

SMILES

Cc1c(cc(cc2)NC(Cc(c(F)ccc3)c3Cl)=O)c2nc(N(CC2)CCN2c2ncccn2)c1

InChI

InChI=1S/C26H24ClFN6O/c1-17-14-24(33-10-12-34(13-11-33)26-29-8-3-9-30-26)32-23-7-6-18(15-19(17)23)31-25(35)16-20-21(27)4-2-5-22(20)28/h2-9,14-15H,10-13,16H2,1H3,(H,31,35)

InChI Key

OHPNFAUHGGDRDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.97

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.985

Distribution Coefficient, logD

5.985

Water Solubility, LogSw

-6.13

Polar Surface Area

55.986

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

C095-0440 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C095-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0440?
Check Price and Availability of C095-0440, 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 C095-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0440
  • 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 C095-0440 available by request