8015-1196 Screening compound: ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate

8015-1196 Screening compound: ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate
8015-1196 Screening compound: ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-1196
ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate

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

8015-1196

Molecular Formula

C16H16ClNO4 (C16 H16 ClNO4)

Compound Name

ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate

IUPAC name

ethyl 3-(2-chlorophenyl)-3-[(furan-2-yl)formamido]propanoate

SMILES

CCOC(CC(c(cccc1)c1Cl)NC(c1ccco1)=O)=O

InChI

InChI=1S/C16H16ClNO4/c1-2-21-15(19)10-13(11-6-3-4-7-12(11)17)18-16(20)14-8-5-9-22-14/h3-9,13H,2,10H2,1H3,(H,18,20)/t13-/m0/s1

InChI Key

WDKFXXYJOUPOEM-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03855666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.76

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.024

Distribution Coefficient, logD

3.024

Water Solubility, LogSw

-3.27

Polar Surface Area

53.019

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-3.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

8015-1196 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8015-1196 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-1196?
Check Price and Availability of 8015-1196, 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 8015-1196 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-1196
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-1196
  • 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 8015-1196 available by request