S700-1359 Screening compound: N,N-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}azetidine-1-sulfonamide

S700-1359 Screening compound: N,N-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}azetidine-1-sulfonamide
S700-1359 Screening compound: N,N-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}azetidine-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S700-1359
N,N-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}azetidine-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

S700-1359

Molecular Formula

C16H22N4O4S (C16 H22 N4 O4 S)

Compound Name

N,N-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-1,2,4-oxadiazol-5-yl}azetidine-1-sulfonamide

IUPAC name

NN-dimethyl-3-{3-[2-(3-methylphenoxy)ethyl]-124-oxadiazol-5-yl}azetidine-1-sulfonamide

SMILES

Cc1cccc(OCCc2noc(C(C3)CN3S(N(C)C)(=O)=O)n2)c1

InChI

InChI=1S/C16H22N4O4S/c1-12-5-4-6-14(9-12)23-8-7-15-17-16(24-18-15)13-10-20(11-13)25(21,22)19(2)3/h4-6,9,13H,7-8,10-11H2,1-3H3

InChI Key

XWDPLHFCBWLPRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31964423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.416

Distribution Coefficient, logD

2.416

Water Solubility, LogSw

-2.73

Polar Surface Area

76.320

Acid Dissociation Constant (pKa)

25.98

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

S700-1359 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S700-1359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S700-1359?
Check Price and Availability of S700-1359, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S700-1359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S700-1359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S700-1359
  • 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 S700-1359 available by request