D151-0233 Screening compound: 5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile

D151-0233 Screening compound: 5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile
D151-0233 Screening compound: 5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound D151-0233
5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile

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

D151-0233

Molecular Formula

C23H21FN4O (C23 H21 FN4 O)

Compound Name

5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile

IUPAC name

5-(4-benzylpiperazin-1-yl)-2-[(1E)-2-(4-fluorophenyl)ethenyl]-13-oxazole-4-carbonitrile

SMILES

N#Cc1c(N2CCN(Cc3ccccc3)CC2)oc(/C=C/c(cc2)ccc2F)n1

InChI

InChI=1S/C23H21FN4O/c24-20-9-6-18(7-10-20)8-11-22-26-21(16-25)23(29-22)28-14-12-27(13-15-28)17-19-4-2-1-3-5-19/h1-11H,12-15,17H2

InChI Key

GIBGMYRJTGMNAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.340

Distribution Coefficient, logD

4.282

Water Solubility, LogSw

-4.34

Polar Surface Area

42.961

Acid Dissociation Constant (pKa)

26.94

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

D151-0233 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D151-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D151-0233?
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What is the minimum amount of D151-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D151-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D151-0233
  • 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 D151-0233 available by request