SA58-0533 Screening compound: 2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,N-dimethylpyrrolidine-1-sulfonamide

SA58-0533 Screening compound: 2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,N-dimethylpyrrolidine-1-sulfonamide
SA58-0533 Screening compound: 2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,N-dimethylpyrrolidine-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA58-0533
2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,N-dimethylpyrrolidine-1-sulfonamide

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

SA58-0533

Molecular Formula

C13H22N4O3S (C13 H22 N4 O3 S)

Compound Name

2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethyl]-N,N-dimethylpyrrolidine-1-sulfonamide

IUPAC name

2-[2-(5-cyclopropyl-124-oxadiazol-3-yl)ethyl]-NN-dimethylpyrrolidine-1-sulfonamide

SMILES

CN(C)S(N1C(CCc2noc(C3CC3)n2)CCC1)(=O)=O

InChI

InChI=1S/C13H22N4O3S/c1-16(2)21(18,19)17-9-3-4-11(17)7-8-12-14-13(20-15-12)10-5-6-10/h10-11H,3-9H2,1-2H3/t11-/m1/s1

InChI Key

UGXIYRUWKLUIAS-LLVKDONJSA-N

MDL Number (MFCD)

MFCD31998986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.654

Distribution Coefficient, logD

1.654

Water Solubility, LogSw

-1.91

Polar Surface Area

70.017

Acid Dissociation Constant (pKa)

24.36

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

84.61

SA58-0533 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SA58-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA58-0533?
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What is the minimum amount of SA58-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA58-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA58-0533
  • 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 SA58-0533 available by request