C301-5481 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxyaniline

C301-5481 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxyaniline
C301-5481 Screening compound: N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxyaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-5481
N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxyaniline

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

C301-5481

Molecular Formula

C23H20ClN3O3 (C23 H20 ClN3 O3)

Compound Name

N-[(4-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,4-dimethoxyaniline

IUPAC name

N-[(4-chlorophenyl)(5-phenyl-134-oxadiazol-2-yl)methyl]-34-dimethoxyaniline

SMILES

COc(ccc(NC(c1nnc(-c2ccccc2)o1)c(cc1)ccc1Cl)c1)c1OC

InChI

InChI=1S/C23H20ClN3O3/c1-28-19-13-12-18(14-20(19)29-2)25-21(15-8-10-17(24)11-9-15)23-27-26-22(30-23)16-6-4-3-5-7-16/h3-14,21,25H,1-2H3/t21-/m1/s1

InChI Key

ZDLACXRYGRNNJC-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD14744003

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

421.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.761

Distribution Coefficient, logD

4.761

Water Solubility, LogSw

-5.17

Polar Surface Area

55.330

Acid Dissociation Constant (pKa)

16.19

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.00

C301-5481 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C301-5481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-5481?
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What is the minimum amount of C301-5481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-5481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-5481
  • 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 C301-5481 available by request