C279-0894 Screening compound: N-[2-(7,8-DIMETHYL-2-OXO-1,2-DIHYDROQUINOLIN-3-YL)ETHYL]-4-METHOXYBENZENE-1-SULFONAMIDE

C279-0894 Screening compound: N-[2-(7,8-DIMETHYL-2-OXO-1,2-DIHYDROQUINOLIN-3-YL)ETHYL]-4-METHOXYBENZENE-1-SULFONAMIDE
C279-0894 Screening compound: N-[2-(7,8-DIMETHYL-2-OXO-1,2-DIHYDROQUINOLIN-3-YL)ETHYL]-4-METHOXYBENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C279-0894
N-[2-(7,8-DIMETHYL-2-OXO-1,2-DIHYDROQUINOLIN-3-YL)ETHYL]-4-METHOXYBENZENE-1-SULFONAMIDE

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

C279-0894

Molecular Formula

C20H22N2O4S (C20 H22 N2 O4 S)

Compound Name

N-[2-(7,8-DIMETHYL-2-OXO-1,2-DIHYDROQUINOLIN-3-YL)ETHYL]-4-METHOXYBENZENE-1-SULFONAMIDE

IUPAC name

n/a

SMILES

Cc(cc1)c(C)c(N2)c1C=C(CCNS(c(cc1)ccc1OC)(=O)=O)C2=O

InChI

InChI=1S/C20H22N2O4S/c1-13-4-5-15-12-16(20(23)22-19(15)14(13)2)10-11-21-27(24,25)18-8-6-17(26-3)7-9-18/h4-9,12,21H,10-11H2,1-3H3,(H,22,23)

InChI Key

KZRLHYPDWZTKRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04463031

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.449

Distribution Coefficient, logD

3.449

Water Solubility, LogSw

-3.83

Polar Surface Area

72.008

Acid Dissociation Constant (pKa)

11.55

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C279-0894 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 C279-0894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C279-0894?
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What is the minimum amount of C279-0894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C279-0894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C279-0894
  • 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 C279-0894 available by request