3851-0168 Screening compound: (3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-2,3-dihydrofuran-2-one

3851-0168 Screening compound: (3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-2,3-dihydrofuran-2-one
3851-0168 Screening compound: (3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-2,3-dihydrofuran-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3851-0168
(3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-2,3-dihydrofuran-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

3851-0168

Molecular Formula

C17H14O4 (C17 H14 O4)

Compound Name

(3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-2,3-dihydrofuran-2-one

IUPAC name

(3E)-3-[(furan-2-yl)methylidene]-5-(2-methoxy-5-methylphenyl)-23-dihydrofuran-2-one

SMILES

Cc(cc1)cc(C(OC2=O)=C/C2=C\c2ccco2)c1OC

InChI

InChI=1S/C17H14O4/c1-11-5-6-15(19-2)14(8-11)16-10-12(17(18)21-16)9-13-4-3-7-20-13/h3-10H,1-2H3

InChI Key

YNADHGBFUXIOCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.446

Distribution Coefficient, logD

3.446

Water Solubility, LogSw

-3.66

Polar Surface Area

38.119

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with 3851-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3851-0168?
Check Price and Availability of 3851-0168, 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 3851-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3851-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3851-0168
  • 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 3851-0168 available by request