M321-0613 Screening compound: 5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole

M321-0613 Screening compound: 5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole
M321-0613 Screening compound: 5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound M321-0613
5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole

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

M321-0613

Molecular Formula

C21H19ClN4O2 (C21 H19 ClN4 O2)

Compound Name

5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazole

IUPAC name

5-[1-(3-chlorophenoxy)ethyl]-3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-124-oxadiazole

SMILES

CCn1nccc1-c1cccc(-c2noc(C(C)Oc3cccc(Cl)c3)n2)c1

InChI

InChI=1S/C21H19ClN4O2/c1-3-26-19(10-11-23-26)15-6-4-7-16(12-15)20-24-21(28-25-20)14(2)27-18-9-5-8-17(22)13-18/h4-14H,3H2,1-2H3/t14-/m0/s1

InChI Key

SRJJQBBURPCGPV-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27536118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.765

Distribution Coefficient, logD

5.765

Water Solubility, LogSw

-6.07

Polar Surface Area

51.251

Acid Dissociation Constant (pKa)

28.84

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.05

M321-0613 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M321-0613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M321-0613?
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What is the minimum amount of M321-0613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M321-0613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M321-0613
  • 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 M321-0613 available by request