C226-0746 Screening compound: N-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide

C226-0746 Screening compound: N-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
C226-0746 Screening compound: N-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C226-0746
N-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-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

C226-0746

Molecular Formula

C17H12ClFN2O3 (C17 H12 ClFN2 O3)

Compound Name

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

IUPAC name

N-(3-chloro-4-fluorophenyl)-5-(4-methoxyphenyl)-12-oxazole-3-carboxamide

SMILES

COc(cc1)ccc1-c1cc(C(Nc(cc2)cc(Cl)c2F)=O)no1

InChI

InChI=1S/C17H12ClFN2O3/c1-23-12-5-2-10(3-6-12)16-9-15(21-24-16)17(22)20-11-4-7-14(19)13(18)8-11/h2-9H,1H3,(H,20,22)

InChI Key

SEUGIDUNXGLDDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09781951

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.544

Distribution Coefficient, logD

4.530

Water Solubility, LogSw

-4.76

Polar Surface Area

52.409

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

-5.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

C226-0746 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

New Agro Library (44492 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 C226-0746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C226-0746?
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What is the minimum amount of C226-0746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C226-0746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C226-0746
  • 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 C226-0746 available by request