7066-7426F Screening compound: (2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-2,3-dihydro-1-benzothiophen-3-one

7066-7426F Screening compound: (2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-2,3-dihydro-1-benzothiophen-3-one
7066-7426F Screening compound: (2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-2,3-dihydro-1-benzothiophen-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7066-7426F
(2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-2,3-dihydro-1-benzothiophen-3-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

7066-7426F

Molecular Formula

C19H15NOS (C19 H15 NOS)

Compound Name

(2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-2,3-dihydro-1-benzothiophen-3-one

IUPAC name

(2E)-2-[(7-ethyl-1H-indol-3-yl)methylidene]-23-dihydro-1-benzothiophen-3-one

SMILES

CCc1cccc2c1[nH]cc2/C=C1/Sc(cccc2)c2C1=O

InChI

InChI=1S/C19H15NOS/c1-2-12-6-5-8-14-13(11-20-18(12)14)10-17-19(21)15-7-3-4-9-16(15)22-17/h3-11,20H,2H2,1H3

InChI Key

KJNOVCQKAPPTSY-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.050

Distribution Coefficient, logD

5.050

Water Solubility, LogSw

-4.86

Polar Surface Area

24.041

Acid Dissociation Constant (pKa)

18.44

Base Dissociation Constant (pKb)

-3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 7066-7426F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7066-7426F?
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What is the minimum amount of 7066-7426F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7066-7426F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7066-7426F
  • 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 7066-7426F available by request