0865-0144 Screening compound: 4-(2,6-dimethyl-4H-pyran-4-ylidene)-2-phenyl-4,5-dihydro-1,3-oxazol-5-one

0865-0144 Screening compound: 4-(2,6-dimethyl-4H-pyran-4-ylidene)-2-phenyl-4,5-dihydro-1,3-oxazol-5-one
0865-0144 Screening compound: 4-(2,6-dimethyl-4H-pyran-4-ylidene)-2-phenyl-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0865-0144
4-(2,6-dimethyl-4H-pyran-4-ylidene)-2-phenyl-4,5-dihydro-1,3-oxazol-5-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

0865-0144

Molecular Formula

C16H13NO3 (C16 H13 NO3)

Compound Name

4-(2,6-dimethyl-4H-pyran-4-ylidene)-2-phenyl-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

4-(26-dimethyl-4H-pyran-4-ylidene)-2-phenyl-45-dihydro-13-oxazol-5-one

SMILES

CC(OC(C)=C1)=CC1=C1N=C(c2ccccc2)OC1=O

InChI

InChI=1S/C16H13NO3/c1-10-8-13(9-11(2)19-10)14-16(18)20-15(17-14)12-6-4-3-5-7-12/h3-9H,1-2H3

InChI Key

DOCUFZCCVXXBFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00422257

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.534

Distribution Coefficient, logD

2.534

Water Solubility, LogSw

-2.60

Polar Surface Area

41.219

Acid Dissociation Constant (pKa)

32.58

Base Dissociation Constant (pKb)

-4.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

0865-0144 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0865-0144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0865-0144?
Check Price and Availability of 0865-0144, 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 0865-0144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0865-0144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0865-0144
  • 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 0865-0144 available by request