SA58-0285 Screening compound: 3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine

SA58-0285 Screening compound: 3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine
SA58-0285 Screening compound: 3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA58-0285
3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-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

SA58-0285

Molecular Formula

C19H19FN4O3S (C19 H19 FN4 O3 S)

Compound Name

3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine

IUPAC name

3-(3-{2-[1-(2-fluorobenzenesulfonyl)pyrrolidin-2-yl]ethyl}-124-oxadiazol-5-yl)pyridine

SMILES

O=S(c(cccc1)c1F)(N1C(CCc2noc(-c3cnccc3)n2)CCC1)=O

InChI

InChI=1S/C19H19FN4O3S/c20-16-7-1-2-8-17(16)28(25,26)24-12-4-6-15(24)9-10-18-22-19(27-23-18)14-5-3-11-21-13-14/h1-3,5,7-8,11,13,15H,4,6,9-10,12H2/t15-/m1/s1

InChI Key

UWMNLCXZUCVRAL-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD32000132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.45

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

2.527

Distribution Coefficient, logD

2.433

Water Solubility, LogSw

-2.21

Polar Surface Area

74.653

Acid Dissociation Constant (pKa)

25.51

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.58

SA58-0285 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SA58-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA58-0285?
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What is the minimum amount of SA58-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA58-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA58-0285
  • 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 SA58-0285 available by request