C769-1860 Screening compound: N-(4-ethoxyphenyl)-6,7-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine

C769-1860 Screening compound: N-(4-ethoxyphenyl)-6,7-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine
C769-1860 Screening compound: N-(4-ethoxyphenyl)-6,7-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C769-1860
N-(4-ethoxyphenyl)-6,7-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine

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

C769-1860

Molecular Formula

C26H26N2O5S (C26 H26 N2 O5 S)

Compound Name

N-(4-ethoxyphenyl)-6,7-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine

IUPAC name

N-(4-ethoxyphenyl)-67-dimethoxy-3-(4-methylbenzenesulfonyl)quinolin-4-amine

SMILES

CCOc(cc1)ccc1Nc(c(c(nc1)c2)cc(OC)c2OC)c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C26H26N2O5S/c1-5-33-19-10-8-18(9-11-19)28-26-21-14-23(31-3)24(32-4)15-22(21)27-16-25(26)34(29,30)20-12-6-17(2)7-13-20/h6-16H,5H2,1-4H3,(H,27,28)

InChI Key

KJMFPBXBHSOHKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.947

Distribution Coefficient, logD

4.947

Water Solubility, LogSw

-4.50

Polar Surface Area

68.493

Acid Dissociation Constant (pKa)

19.50

Base Dissociation Constant (pKb)

2.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

C769-1860 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antifungal Library (16415 compounds)

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C769-1860 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C769-1860?
Check Price and Availability of C769-1860, 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 C769-1860 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C769-1860
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C769-1860
  • 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 C769-1860 available by request