6969-0915 Screening compound: 1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-2-one

6969-0915 Screening compound: 1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-2-one
6969-0915 Screening compound: 1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6969-0915
1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-2-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

6969-0915

Molecular Formula

C18H19NO3S (C18 H19 NO3 S)

Compound Name

1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-indol-2-one

IUPAC name

1-butyl-3-hydroxy-3-[2-oxo-2-(thiophen-2-yl)ethyl]-23-dihydro-1H-indol-2-one

SMILES

CCCCN(C(C1(CC(c2cccs2)=O)O)=O)c2c1cccc2

InChI

InChI=1S/C18H19NO3S/c1-2-3-10-19-14-8-5-4-7-13(14)18(22,17(19)21)12-15(20)16-9-6-11-23-16/h4-9,11,22H,2-3,10,12H2,1H3/t18-/m0/s1

InChI Key

JYXWVMPPKHJOQW-SFHVURJKSA-N

MDL Number (MFCD)

MFCD03837252

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.167

Distribution Coefficient, logD

3.167

Water Solubility, LogSw

-3.61

Polar Surface Area

45.311

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

6969-0915 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6969-0915 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6969-0915?
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What is the minimum amount of 6969-0915 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6969-0915
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6969-0915
  • 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 6969-0915 available by request