8018-5985 Screening compound: 2-methyl-1-(2,3,4,5-tetramethylbenzenesulfonyl)-2,3-dihydro-1H-indole

8018-5985 Screening compound: 2-methyl-1-(2,3,4,5-tetramethylbenzenesulfonyl)-2,3-dihydro-1H-indole
8018-5985 Screening compound: 2-methyl-1-(2,3,4,5-tetramethylbenzenesulfonyl)-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5985
2-methyl-1-(2,3,4,5-tetramethylbenzenesulfonyl)-2,3-dihydro-1H-indole

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

8018-5985

Molecular Formula

C19H23NO2S (C19 H23 NO2 S)

Compound Name

2-methyl-1-(2,3,4,5-tetramethylbenzenesulfonyl)-2,3-dihydro-1H-indole

IUPAC name

2-methyl-1-(2345-tetramethylbenzenesulfonyl)-23-dihydro-1H-indole

SMILES

CC(Cc1c2cccc1)N2S(c1c(C)c(C)c(C)c(C)c1)(=O)=O

InChI

InChI=1S/C19H23NO2S/c1-12-10-19(16(5)15(4)14(12)3)23(21,22)20-13(2)11-17-8-6-7-9-18(17)20/h6-10,13H,11H2,1-5H3/t13-/m0/s1

InChI Key

RSVKANFEVVSNQJ-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD07800755

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.378

Distribution Coefficient, logD

5.378

Water Solubility, LogSw

-5.44

Polar Surface Area

31.473

Acid Dissociation Constant (pKa)

26.07

Base Dissociation Constant (pKb)

-9.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

8018-5985 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Digestive system
  • Nervous system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with 8018-5985 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5985?
Check Price and Availability of 8018-5985, 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 8018-5985 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5985
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5985
  • 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 8018-5985 available by request