SC08-0126 Screening compound: 3-(1H-imidazol-1-yl)-1-(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)-1-propanone

SC08-0126 Screening compound: 3-(1H-imidazol-1-yl)-1-(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)-1-propanone
SC08-0126 Screening compound: 3-(1H-imidazol-1-yl)-1-(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC08-0126
3-(1H-imidazol-1-yl)-1-(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)-1-propanone

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

SC08-0126

Molecular Formula

C17H24N6O4S (C17 H24 N6 O4 S)

Compound Name

3-(1H-imidazol-1-yl)-1-(3-{3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}-1-azetanyl)-1-propanone

IUPAC name

3-(1H-imidazol-1-yl)-1-{3-[3-(1-methanesulfonylpiperidin-4-yl)-124-oxadiazol-5-yl]azetidin-1-yl}propan-1-one

SMILES

CS(N(CC1)CCC1c1noc(C(C2)CN2C(CCn2cncc2)=O)n1)(=O)=O

InChI

InChI=1S/C17H24N6O4S/c1-28(25,26)23-7-2-13(3-8-23)16-19-17(27-20-16)14-10-22(11-14)15(24)4-6-21-9-5-18-12-21/h5,9,12-14H,2-4,6-8,10-11H2,1H3

InChI Key

RFKWMXOWEARLQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32254106

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.053

Distribution Coefficient, logD

-0.140

Water Solubility, LogSw

-1.25

Polar Surface Area

92.238

Acid Dissociation Constant (pKa)

22.71

Base Dissociation Constant (pKb)

6.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.71

SC08-0126 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Arginase Targeted Library (2009 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with SC08-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC08-0126?
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What is the minimum amount of SC08-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC08-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC08-0126
  • 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 SC08-0126 available by request