M321-0014 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-{3-[3-(1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}piperidine

M321-0014 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-{3-[3-(1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}piperidine
M321-0014 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-{3-[3-(1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound M321-0014
1-(4-chlorobenzenesulfonyl)-4-{3-[3-(1H-pyrazol-5-yl)phenyl]-1,2,4-oxadiazol-5-yl}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

M321-0014

Molecular Formula

C22H20ClN5O3S (C22 H20 ClN5 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=S(c(cc1)ccc1Cl)(N(CC1)CCC1c1nc(-c2cc(-c3ccn[nH]3)ccc2)no1)=O

InChI

InChI=1S/C22H20ClN5O3S/c23-18-4-6-19(7-5-18)32(29,30)28-12-9-15(10-13-28)22-25-21(27-31-22)17-3-1-2-16(14-17)20-8-11-24-26-20/h1-8,11,14-15H,9-10,12-13H2,(H,24,26)

InChI Key

HJYSXGHDUFHPNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.95

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.108

Water Solubility, LogSw

-5.78

Polar Surface Area

86.685

Acid Dissociation Constant (pKa)

8.41

Base Dissociation Constant (pKb)

1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M321-0014 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M321-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M321-0014?
Check Price and Availability of M321-0014, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M321-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M321-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M321-0014
  • 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 M321-0014 available by request