C769-1855 Screening compound: N-(4-ethoxyphenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine

C769-1855 Screening compound: N-(4-ethoxyphenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine
C769-1855 Screening compound: N-(4-ethoxyphenyl)-3-(4-methylbenzenesulfonyl)quinolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C769-1855
N-(4-ethoxyphenyl)-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

C769-1855

Molecular Formula

C24H22N2O3S (C24 H22 N2 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCOc(cc1)ccc1Nc(c1ccccc1nc1)c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C24H22N2O3S/c1-3-29-19-12-10-18(11-13-19)26-24-21-6-4-5-7-22(21)25-16-23(24)30(27,28)20-14-8-17(2)9-15-20/h4-16H,3H2,1-2H3,(H,25,26)

InChI Key

SWCTWCFIXISUJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.369

Distribution Coefficient, logD

5.369

Water Solubility, LogSw

-5.53

Polar Surface Area

53.232

Acid Dissociation Constant (pKa)

18.28

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

C769-1855 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C769-1855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C769-1855?
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What is the minimum amount of C769-1855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C769-1855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C769-1855
  • 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 C769-1855 available by request