C226-0310 Screening compound: N-(3-acetylphenyl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide

C226-0310 Screening compound: N-(3-acetylphenyl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide
C226-0310 Screening compound: N-(3-acetylphenyl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-0310
N-(3-acetylphenyl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide

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

C226-0310

Molecular Formula

C18H13FN2O3 (C18 H13 FN2 O3)

Compound Name

N-(3-acetylphenyl)-5-(4-fluorophenyl)-1,2-oxazole-3-carboxamide

IUPAC name

N-(3-acetylphenyl)-5-(4-fluorophenyl)-12-oxazole-3-carboxamide

SMILES

CC(c1cccc(NC(c2noc(-c(cc3)ccc3F)c2)=O)c1)=O

InChI

InChI=1S/C18H13FN2O3/c1-11(22)13-3-2-4-15(9-13)20-18(23)16-10-17(24-21-16)12-5-7-14(19)8-6-12/h2-10H,1H3,(H,20,23)

InChI Key

XVHNMZSXKGOWPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09781657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.602

Distribution Coefficient, logD

3.602

Water Solubility, LogSw

-3.82

Polar Surface Area

58.692

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-4.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

C226-0310 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Selective Target Activity Profiling Library (14702 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

References: we are preparing a list of scientific research reports with C226-0310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-0310?
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What is the minimum amount of C226-0310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-0310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-0310
  • 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 C226-0310 available by request