2144-0984 Screening compound: (2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-2,3-dihydro-1-benzothiophen-3-one

2144-0984 Screening compound: (2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-2,3-dihydro-1-benzothiophen-3-one
2144-0984 Screening compound: (2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-2,3-dihydro-1-benzothiophen-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2144-0984
(2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)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

2144-0984

Molecular Formula

C18H15IO3S (C18 H15 IO3 S)

Compound Name

(2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-2,3-dihydro-1-benzothiophen-3-one

IUPAC name

(2Z)-2-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-23-dihydro-1-benzothiophen-3-one

SMILES

CCOc(c(OC)cc(/C=C1\Sc(cccc2)c2C1=O)c1)c1I

InChI

InChI=1S/C18H15IO3S/c1-3-22-18-13(19)8-11(9-14(18)21-2)10-16-17(20)12-6-4-5-7-15(12)23-16/h4-10H,3H2,1-2H3

InChI Key

AWDPUWODVWOFJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01066105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.124

Distribution Coefficient, logD

5.124

Water Solubility, LogSw

-5.00

Polar Surface Area

28.327

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 2144-0984 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2144-0984?
Check Price and Availability of 2144-0984, 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 2144-0984 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2144-0984
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2144-0984
  • 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 2144-0984 available by request