8397-0558 Screening compound: 7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol

8397-0558 Screening compound: 7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol
8397-0558 Screening compound: 7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8397-0558
7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol

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

8397-0558

Molecular Formula

C23H21N3O2 (C23 H21 N3 O2)

Compound Name

7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol

IUPAC name

7-{[(2-methoxy-5-methylphenyl)amino](pyridin-2-yl)methyl}quinolin-8-ol

SMILES

Cc(cc1)cc(NC(c(ccc2cccnc22)c2O)c2ncccc2)c1OC

InChI

InChI=1S/C23H21N3O2/c1-15-8-11-20(28-2)19(14-15)26-22(18-7-3-4-12-24-18)17-10-9-16-6-5-13-25-21(16)23(17)27/h3-14,22,26-27H,1-2H3/t22-/m0/s1

InChI Key

CBKAKNIYXPYCGO-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD07656551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.992

Distribution Coefficient, logD

3.991

Water Solubility, LogSw

-3.77

Polar Surface Area

50.546

Acid Dissociation Constant (pKa)

10.20

Base Dissociation Constant (pKb)

4.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

8397-0558 in Drug Discovery

Included in Screening Libraries

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

Chelators targeting matrix metalloproteinases library (8930 compounds)

DGK Inhibitors Library (10558 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Kinases

References: we are preparing a list of scientific research reports with 8397-0558 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8397-0558?
Check Price and Availability of 8397-0558, 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 8397-0558 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8397-0558
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8397-0558
  • 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 8397-0558 available by request