5218-2753 Screening compound: 3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid

5218-2753 Screening compound: 3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid
5218-2753 Screening compound: 3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5218-2753
3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid

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

5218-2753

Molecular Formula

C13H12FNO2 (C13 H12 FNO2)

Compound Name

3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid

IUPAC name

3-(4-fluorophenyl)-3-(furan-2-yl)propanimidic acid

SMILES

N=C(CC(c1ccco1)c(cc1)ccc1F)O

InChI

InChI=1S/C13H12FNO2/c14-10-5-3-9(4-6-10)11(8-13(15)16)12-2-1-7-17-12/h1-7,11H,8H2,(H2,15,16)/t11-/m1/s1

InChI Key

WHFLBQFRLCHZJO-LLVKDONJSA-N

MDL Number (MFCD)

MFCD02987897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

233.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.128

Distribution Coefficient, logD

1.234

Water Solubility, LogSw

-2.28

Polar Surface Area

42.369

Acid Dissociation Constant (pKa)

6.31

Base Dissociation Constant (pKb)

7.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 5218-2753 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5218-2753?
Check Price and Availability of 5218-2753, 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 5218-2753 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5218-2753
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5218-2753
  • 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 5218-2753 available by request