SA92-0406 Screening compound: 3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine

SA92-0406 Screening compound: 3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine
SA92-0406 Screening compound: 3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA92-0406
3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine

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

SA92-0406

Molecular Formula

C14H19FN4O (C14 H19 FN4 O)

Compound Name

3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine

IUPAC name

3-fluoro-3-(3-methyl-124-oxadiazol-5-yl)-1-[(1-methyl-1H-pyrrol-2-yl)methyl]piperidine

SMILES

Cc1noc(C2(CN(Cc3cccn3C)CCC2)F)n1

InChI

InChI=1S/C14H19FN4O/c1-11-16-13(20-17-11)14(15)6-4-8-19(10-14)9-12-5-3-7-18(12)2/h3,5,7H,4,6,8-10H2,1-2H3/t14-/m0/s1

InChI Key

XZEPWWLVZDQQSZ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD32241577

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.679

Distribution Coefficient, logD

1.616

Water Solubility, LogSw

-1.80

Polar Surface Area

38.092

Acid Dissociation Constant (pKa)

26.95

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

SA92-0406 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with SA92-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA92-0406?
Check Price and Availability of SA92-0406, 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 SA92-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA92-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA92-0406
  • 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 SA92-0406 available by request