M321-0481 Screening compound: 4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine

M321-0481 Screening compound: 4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine
M321-0481 Screening compound: 4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound M321-0481
4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine

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

M321-0481

Molecular Formula

C25H27N5O3S (C25 H27 N5 O3 S)

Compound Name

4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine

IUPAC name

4-{3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-124-oxadiazol-5-yl}-1-(4-methylbenzenesulfonyl)piperidine

SMILES

CCn1nccc1-c1cccc(-c2noc(C(CC3)CCN3S(c3ccc(C)cc3)(=O)=O)n2)c1

InChI

InChI=1S/C25H27N5O3S/c1-3-30-23(11-14-26-30)20-5-4-6-21(17-20)24-27-25(33-28-24)19-12-15-29(16-13-19)34(31,32)22-9-7-18(2)8-10-22/h4-11,14,17,19H,3,12-13,15-16H2,1-2H3

InChI Key

KDSDELZJGBFATG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27536071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.146

Distribution Coefficient, logD

5.146

Water Solubility, LogSw

-5.14

Polar Surface Area

76.173

Acid Dissociation Constant (pKa)

26.56

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

M321-0481 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with M321-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M321-0481?
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What is the minimum amount of M321-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M321-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M321-0481
  • 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 M321-0481 available by request