Y040-6092 Screening compound: 7-chloro-3-hydroxy-3-[2-oxo-2-(thiophen-3-yl)ethyl]-2,3-dihydro-1H-indol-2-one

Y040-6092 Screening compound: 7-chloro-3-hydroxy-3-[2-oxo-2-(thiophen-3-yl)ethyl]-2,3-dihydro-1H-indol-2-one
Y040-6092 Screening compound: 7-chloro-3-hydroxy-3-[2-oxo-2-(thiophen-3-yl)ethyl]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-6092
7-chloro-3-hydroxy-3-[2-oxo-2-(thiophen-3-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

Y040-6092

Molecular Formula

C14H10ClNO3S (C14 H10 ClNO3 S)

Compound Name

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

IUPAC name

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

SMILES

OC(CC(c1cscc1)=O)(c1cccc(Cl)c1N1)C1=O

InChI

InChI=1S/C14H10ClNO3S/c15-10-3-1-2-9-12(10)16-13(18)14(9,19)6-11(17)8-4-5-20-7-8/h1-5,7,19H,6H2,(H,16,18)/t14-/m0/s1

InChI Key

UOJNCNSEHQXMAX-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD12213888

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.76

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.104

Distribution Coefficient, logD

2.101

Water Solubility, LogSw

-3.17

Polar Surface Area

52.584

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

-2.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.29

Y040-6092 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with Y040-6092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-6092?
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What is the minimum amount of Y040-6092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-6092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-6092
  • 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 Y040-6092 available by request