SC08-0014 Screening compound: (3,4-dimethylphenyl)(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)methanone

SC08-0014 Screening compound: (3,4-dimethylphenyl)(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)methanone
SC08-0014 Screening compound: (3,4-dimethylphenyl)(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC08-0014
(3,4-dimethylphenyl)(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)methanone

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

SC08-0014

Molecular Formula

C20H26N4O4S (C20 H26 N4 O4 S)

Compound Name

(3,4-dimethylphenyl)(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)methanone

IUPAC name

4-{5-[1-(34-dimethylbenzoyl)azetidin-3-yl]-124-oxadiazol-3-yl}-1-methanesulfonylpiperidine

SMILES

Cc(cc1)c(C)cc1C(N(C1)CC1c1nc(C(CC2)CCN2S(C)(=O)=O)no1)=O

InChI

InChI=1S/C20H26N4O4S/c1-13-4-5-16(10-14(13)2)20(25)23-11-17(12-23)19-21-18(22-28-19)15-6-8-24(9-7-15)29(3,26)27/h4-5,10,15,17H,6-9,11-12H2,1-3H3

InChI Key

MLYQOZOXWVXTTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32254739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.545

Distribution Coefficient, logD

2.545

Water Solubility, LogSw

-2.71

Polar Surface Area

79.965

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

-0.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

SC08-0014 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC08-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC08-0014?
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What is the minimum amount of SC08-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC08-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC08-0014
  • 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 SC08-0014 available by request