CM3759-7145 Screening compound: 3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

CM3759-7145 Screening compound: 3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine
CM3759-7145 Screening compound: 3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3759-7145
3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

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

CM3759-7145

Molecular Formula

C20H21FN4O4S (C20 H21 FN4 O4 S)

Compound Name

3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-1,2,4-oxadiazol-5-yl}pyridine

IUPAC name

3-{3-[1-(5-fluoro-2-methoxybenzenesulfonyl)-4-methylpiperidin-4-yl]-124-oxadiazol-5-yl}pyridine

SMILES

CC(CC1)(CCN1S(c(cc(cc1)F)c1OC)(=O)=O)c1noc(-c2cnccc2)n1

InChI

InChI=1S/C20H21FN4O4S/c1-20(19-23-18(29-24-19)14-4-3-9-22-13-14)7-10-25(11-8-20)30(26,27)17-12-15(21)5-6-16(17)28-2/h3-6,9,12-13H,7-8,10-11H2,1-2H3

InChI Key

HSYVRUHVZGLUEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30460201

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.835

Distribution Coefficient, logD

2.742

Water Solubility, LogSw

-2.98

Polar Surface Area

80.503

Acid Dissociation Constant (pKa)

27.69

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

CM3759-7145 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 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 CM3759-7145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3759-7145?
Check Price and Availability of CM3759-7145, 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 CM3759-7145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3759-7145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3759-7145
  • 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 CM3759-7145 available by request