D468-1553 Screening compound: N-(8-butoxyquinolin-5-yl)-4-methylbenzamide

D468-1553 Screening compound: N-(8-butoxyquinolin-5-yl)-4-methylbenzamide
D468-1553 Screening compound: N-(8-butoxyquinolin-5-yl)-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D468-1553
N-(8-butoxyquinolin-5-yl)-4-methylbenzamide

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

D468-1553

Molecular Formula

C21H22N2O2 (C21 H22 N2 O2)

Compound Name

N-(8-butoxyquinolin-5-yl)-4-methylbenzamide

IUPAC name

N-(8-butoxyquinolin-5-yl)-4-methylbenzamide

SMILES

CCCCOc(c1ncccc11)ccc1NC(c1ccc(C)cc1)=O

InChI

InChI=1S/C21H22N2O2/c1-3-4-14-25-19-12-11-18(17-6-5-13-22-20(17)19)23-21(24)16-9-7-15(2)8-10-16/h5-13H,3-4,14H2,1-2H3,(H,23,24)

InChI Key

LFWIERJZGOUKLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14830420

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.820

Distribution Coefficient, logD

4.818

Water Solubility, LogSw

-4.71

Polar Surface Area

39.669

Acid Dissociation Constant (pKa)

10.13

Base Dissociation Constant (pKb)

4.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

D468-1553 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D468-1553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D468-1553?
Check Price and Availability of D468-1553, 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 D468-1553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D468-1553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D468-1553
  • 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 D468-1553 available by request