C651-0349 Screening compound: N-(4-acetylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

C651-0349 Screening compound: N-(4-acetylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide
C651-0349 Screening compound: N-(4-acetylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C651-0349
N-(4-acetylphenyl)-3-(2-fluorophenyl)-4,5-dihydro-1,2-oxazole-5-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

C651-0349

Molecular Formula

C18H15FN2O3 (C18 H15 FN2 O3)

Compound Name

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

IUPAC name

N-(4-acetylphenyl)-3-(2-fluorophenyl)-45-dihydro-12-oxazole-5-carboxamide

SMILES

CC(c(cc1)ccc1NC(C(C1)ON=C1c(cccc1)c1F)=O)=O

InChI

InChI=1S/C18H15FN2O3/c1-11(22)12-6-8-13(9-7-12)20-18(23)17-10-16(21-24-17)14-4-2-3-5-15(14)19/h2-9,17H,10H2,1H3,(H,20,23)/t17-/m1/s1

InChI Key

RKMOKJUXKKPILV-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD08106381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.33

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

2.658

Distribution Coefficient, logD

2.656

Water Solubility, LogSw

-3.41

Polar Surface Area

59.750

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

-3.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

C651-0349 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C651-0349 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C651-0349?
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What is the minimum amount of C651-0349 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C651-0349
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C651-0349
  • 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 C651-0349 available by request