E198-0119 Screening compound: 1,3,3-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide

E198-0119 Screening compound: 1,3,3-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide
E198-0119 Screening compound: 1,3,3-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E198-0119
1,3,3-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-2,3-dihydro-1H-indole-5-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

E198-0119

Molecular Formula

C20H24N2O3S (C20 H24 N2 O3 S)

Compound Name

1,3,3-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

133-trimethyl-N-[2-(4-methylphenyl)ethyl]-2-oxo-23-dihydro-1H-indole-5-sulfonamide

SMILES

CC(C)(c(cc(cc1)S(NCCc2ccc(C)cc2)(=O)=O)c1N1C)C1=O

InChI

InChI=1S/C20H24N2O3S/c1-14-5-7-15(8-6-14)11-12-21-26(24,25)16-9-10-18-17(13-16)20(2,3)19(23)22(18)4/h5-10,13,21H,11-12H2,1-4H3

InChI Key

OACGHMKATYJPLA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14845056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.414

Distribution Coefficient, logD

3.414

Water Solubility, LogSw

-3.95

Polar Surface Area

57.344

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

-3.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

E198-0119 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 E198-0119 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E198-0119?
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What is the minimum amount of E198-0119 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E198-0119
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E198-0119
  • 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 E198-0119 available by request