D144-0996 Screening compound: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

D144-0996 Screening compound: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide
D144-0996 Screening compound: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D144-0996
2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

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

D144-0996

Molecular Formula

C19H15ClFNO4 (C19 H15 ClFNO4)

Compound Name

2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

IUPAC name

2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[(4-fluorophenyl)methyl]acetamide

SMILES

CC(c(c(O1)c2)cc(Cl)c2O)=C(CC(NCc(cc2)ccc2F)=O)C1=O

InChI

InChI=1S/C19H15ClFNO4/c1-10-13-6-15(20)16(23)8-17(13)26-19(25)14(10)7-18(24)22-9-11-2-4-12(21)5-3-11/h2-6,8,23H,7,9H2,1H3,(H,22,24)

InChI Key

QWRMCSJBFLOFLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06439611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.78

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.525

Distribution Coefficient, logD

3.198

Water Solubility, LogSw

-3.62

Polar Surface Area

61.908

Acid Dissociation Constant (pKa)

7.35

Base Dissociation Constant (pKb)

-1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

D144-0996 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Adenosine Receptors Targeted Library (19896 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
Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D144-0996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D144-0996?
Check Price and Availability of D144-0996, 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 D144-0996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D144-0996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D144-0996
  • 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 D144-0996 available by request