C301-6122 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]aniline

C301-6122 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]aniline
C301-6122 Screening compound: N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-6122
N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]aniline

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

C301-6122

Molecular Formula

C21H15ClFN3O (C21 H15 ClFN3 O)

Compound Name

N-[(2-chloro-4-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]aniline

IUPAC name

N-[(2-chloro-4-fluorophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]aniline

SMILES

Fc1cc(Cl)c(C(c2nnc(-c3ccccc3)o2)Nc2ccccc2)cc1

InChI

InChI=1S/C21H15ClFN3O/c22-18-13-15(23)11-12-17(18)19(24-16-9-5-2-6-10-16)21-26-25-20(27-21)14-7-3-1-4-8-14/h1-13,19,24H/t19-/m1/s1

InChI Key

SINRGORFZHZRJI-LJQANCHMSA-N

MDL Number (MFCD)

MFCD14744302

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.82

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.577

Distribution Coefficient, logD

5.577

Water Solubility, LogSw

-6.13

Polar Surface Area

40.069

Acid Dissociation Constant (pKa)

17.50

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with C301-6122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-6122?
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What is the minimum amount of C301-6122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-6122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-6122
  • 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 C301-6122 available by request