C095-0161 Screening compound: 2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]acetamide

C095-0161 Screening compound: 2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]acetamide
C095-0161 Screening compound: 2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0161
2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-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

C095-0161

Molecular Formula

C22H22ClN3O2 (C22 H22 ClN3 O2)

Compound Name

2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]acetamide

IUPAC name

2-(4-chlorophenyl)-N-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]acetamide

SMILES

Cc1c(cc(cc2)NC(Cc(cc3)ccc3Cl)=O)c2nc(N2CCOCC2)c1

InChI

InChI=1S/C22H22ClN3O2/c1-15-12-21(26-8-10-28-11-9-26)25-20-7-6-18(14-19(15)20)24-22(27)13-16-2-4-17(23)5-3-16/h2-7,12,14H,8-11,13H2,1H3,(H,24,27)

InChI Key

BRSCCZOGXLYRIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.814

Distribution Coefficient, logD

4.814

Water Solubility, LogSw

-4.74

Polar Surface Area

42.271

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C095-0161 in Drug Discovery

Included in Screening Libraries

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

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C095-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0161?
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What is the minimum amount of C095-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0161
  • 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 C095-0161 available by request