C301-4957 Screening compound: 1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}piperazine

C301-4957 Screening compound: 1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}piperazine
C301-4957 Screening compound: 1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4957
1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}piperazine

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

C301-4957

Molecular Formula

C19H18ClFN4O (C19 H18 ClFN4 O)

Compound Name

1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl}piperazine

IUPAC name

1-(3-chlorophenyl)-4-{[5-(4-fluorophenyl)-134-oxadiazol-2-yl]methyl}piperazine

SMILES

Fc(cc1)ccc1-c1nnc(CN(CC2)CCN2c2cccc(Cl)c2)o1

InChI

InChI=1S/C19H18ClFN4O/c20-15-2-1-3-17(12-15)25-10-8-24(9-11-25)13-18-22-23-19(26-18)14-4-6-16(21)7-5-14/h1-7,12H,8-11,13H2

InChI Key

MLQJPHOIFFGTAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12296913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.83

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.495

Distribution Coefficient, logD

3.495

Water Solubility, LogSw

-3.85

Polar Surface Area

37.413

Acid Dissociation Constant (pKa)

27.74

Base Dissociation Constant (pKb)

3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

C301-4957 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C301-4957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4957?
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What is the minimum amount of C301-4957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4957
  • 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 C301-4957 available by request