M950-0683 Screening compound: 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N~3~-(2-fluorophenyl)-2,4-dimethyl-1H-pyrrole-3-sulfonamide

M950-0683 Screening compound: 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N~3~-(2-fluorophenyl)-2,4-dimethyl-1H-pyrrole-3-sulfonamide
M950-0683 Screening compound: 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N~3~-(2-fluorophenyl)-2,4-dimethyl-1H-pyrrole-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M950-0683
5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N~3~-(2-fluorophenyl)-2,4-dimethyl-1H-pyrrole-3-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

M950-0683

Molecular Formula

C18H19FN4O3S (C18 H19 FN4 O3 S)

Compound Name

5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N~3~-(2-fluorophenyl)-2,4-dimethyl-1H-pyrrole-3-sulfonamide

IUPAC name

5-(5-cyclobutyl-134-oxadiazol-2-yl)-N-(2-fluorophenyl)-24-dimethyl-1H-pyrrole-3-sulfonamide

SMILES

Cc1c(-c2nnc(C3CCC3)o2)[nH]c(C)c1S(Nc(cccc1)c1F)(=O)=O

InChI

InChI=1S/C18H19FN4O3S/c1-10-15(18-22-21-17(26-18)12-6-5-7-12)20-11(2)16(10)27(24,25)23-14-9-4-3-8-13(14)19/h3-4,8-9,12,20,23H,5-7H2,1-2H3

InChI Key

XCMCQVXNTPCHKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27556950

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.897

Distribution Coefficient, logD

2.191

Water Solubility, LogSw

-3.29

Polar Surface Area

81.939

Acid Dissociation Constant (pKa)

6.79

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

M950-0683 in Drug Discovery

Included in Screening Libraries

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

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with M950-0683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M950-0683?
Check Price and Availability of M950-0683, 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 M950-0683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M950-0683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M950-0683
  • 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 M950-0683 available by request