C589-0148 Screening compound: 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one

C589-0148 Screening compound: 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one
C589-0148 Screening compound: 2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C589-0148
2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one

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

C589-0148

Molecular Formula

C24H24ClNO2 (C24 H24 ClNO2)

Compound Name

2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-6,6-dimethyl-4,5,6,7-tetrahydro-1H-indol-4-one

IUPAC name

2-(4-chlorophenyl)-1-(2-methoxy-5-methylphenyl)-66-dimethyl-4567-tetrahydro-1H-indol-4-one

SMILES

CC(C)(Cc1c2cc(-c(cc3)ccc3Cl)n1-c(cc(C)cc1)c1OC)CC2=O

InChI

InChI=1S/C24H24ClNO2/c1-15-5-10-23(28-4)20(11-15)26-19(16-6-8-17(25)9-7-16)12-18-21(26)13-24(2,3)14-22(18)27/h5-12H,13-14H2,1-4H3

InChI Key

DGHQSGCGOLCWJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14773099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.91

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.170

Distribution Coefficient, logD

6.170

Water Solubility, LogSw

-6.07

Polar Surface Area

22.144

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

-1.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C589-0148 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C589-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C589-0148?
Check Price and Availability of C589-0148, 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 C589-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C589-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C589-0148
  • 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 C589-0148 available by request