C138-1975 Screening compound: 5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide

C138-1975 Screening compound: 5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide
C138-1975 Screening compound: 5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C138-1975
5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide

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

C138-1975

Molecular Formula

C22H22BrClN4O (C22 H22 BrClN4 O)

Compound Name

5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide

IUPAC name

5-bromo-2-chloro-N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]benzamide

SMILES

Cc1c(cc(cc2)NC(c(cc(cc3)Br)c3Cl)=O)c2nc(N2CCN(C)CC2)c1

InChI

InChI=1S/C22H22BrClN4O/c1-14-11-21(28-9-7-27(2)8-10-28)26-20-6-4-16(13-17(14)20)25-22(29)18-12-15(23)3-5-19(18)24/h3-6,11-13H,7-10H2,1-2H3,(H,25,29)

InChI Key

OKLKTRHUHBRGKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14722173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.737

Distribution Coefficient, logD

5.167

Water Solubility, LogSw

-5.99

Polar Surface Area

38.053

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C138-1975 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Lipid Metabolism Library (9174 compounds)

Epigenetics Focused Set (26518 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C138-1975 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C138-1975?
Check Price and Availability of C138-1975, 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 C138-1975 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C138-1975
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C138-1975
  • 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 C138-1975 available by request