SC18-0233 Screening compound: N~1~-methyl-N~1~-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)-1-cyclopropanesulfonamide

SC18-0233 Screening compound: N~1~-methyl-N~1~-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)-1-cyclopropanesulfonamide
SC18-0233 Screening compound: N~1~-methyl-N~1~-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)-1-cyclopropanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC18-0233
N~1~-methyl-N~1~-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)-1-cyclopropanesulfonamide

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

SC18-0233

Molecular Formula

C13H22N4O5S2 (C13 H22 N4 O5 S2)

Compound Name

N~1~-methyl-N~1~-({3-[1-(methylsulfonyl)-4-piperidyl]-1,2,4-oxadiazol-5-yl}methyl)-1-cyclopropanesulfonamide

IUPAC name

N-{[3-(1-methanesulfonylpiperidin-4-yl)-124-oxadiazol-5-yl]methyl}-N-methylcyclopropanesulfonamide

SMILES

CN(Cc1nc(C(CC2)CCN2S(C)(=O)=O)no1)S(C1CC1)(=O)=O

InChI

InChI=1S/C13H22N4O5S2/c1-16(24(20,21)11-3-4-11)9-12-14-13(15-22-12)10-5-7-17(8-6-10)23(2,18)19/h10-11H,3-9H2,1-2H3

InChI Key

ASWBTLAMQJAUEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32256740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.47

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.461

Distribution Coefficient, logD

0.461

Water Solubility, LogSw

-1.19

Polar Surface Area

96.144

Acid Dissociation Constant (pKa)

19.15

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

84.61

SC18-0233 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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 SC18-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC18-0233?
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What is the minimum amount of SC18-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC18-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC18-0233
  • 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 SC18-0233 available by request