C138-2004 Screening compound: N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1-cyclohexanecarboxamide

C138-2004 Screening compound: N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1-cyclohexanecarboxamide
C138-2004 Screening compound: N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1-cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C138-2004
N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1-cyclohexanecarboxamide

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

C138-2004

Molecular Formula

C22H30N4O (C22 H30 N4 O)

Compound Name

N-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]-1-cyclohexanecarboxamide

IUPAC name

N-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]cyclohexanecarboxamide

SMILES

Cc1c(cc(cc2)NC(C3CCCCC3)=O)c2nc(N2CCN(C)CC2)c1

InChI

InChI=1S/C22H30N4O/c1-16-14-21(26-12-10-25(2)11-13-26)24-20-9-8-18(15-19(16)20)23-22(27)17-6-4-3-5-7-17/h8-9,14-15,17H,3-7,10-13H2,1-2H3,(H,23,27)

InChI Key

SHFYLDMJRJYEIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14722184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.51

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

4.411

Distribution Coefficient, logD

3.841

Water Solubility, LogSw

-4.25

Polar Surface Area

38.245

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.54

C138-2004 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with C138-2004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C138-2004?
Check Price and Availability of C138-2004, 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 C138-2004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C138-2004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C138-2004
  • 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 C138-2004 available by request