S935-0067 Screening compound: N,N-dimethyl-2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide

S935-0067 Screening compound: N,N-dimethyl-2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide
S935-0067 Screening compound: N,N-dimethyl-2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S935-0067
N,N-dimethyl-2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-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

S935-0067

Molecular Formula

C15H20N4O3S (C15 H20 N4 O3 S)

Compound Name

N,N-dimethyl-2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide

IUPAC name

NN-dimethyl-2-[(5-phenyl-124-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide

SMILES

CN(C)S(N1C(Cc2noc(-c3ccccc3)n2)CCC1)(=O)=O

InChI

InChI=1S/C15H20N4O3S/c1-18(2)23(20,21)19-10-6-9-13(19)11-14-16-15(22-17-14)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3/t13-/m1/s1

InChI Key

IGAXVCJHIAVFLZ-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD31995385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.911

Distribution Coefficient, logD

1.911

Water Solubility, LogSw

-2.45

Polar Surface Area

69.493

Acid Dissociation Constant (pKa)

27.51

Base Dissociation Constant (pKb)

-3.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.67

S935-0067 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S935-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S935-0067?
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What is the minimum amount of S935-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S935-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S935-0067
  • 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 S935-0067 available by request