SA69-1153 Screening compound: 1-(2,5-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-methylpiperidine

SA69-1153 Screening compound: 1-(2,5-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-methylpiperidine
SA69-1153 Screening compound: 1-(2,5-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA69-1153
1-(2,5-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-methylpiperidine

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

SA69-1153

Molecular Formula

C21H22FN3O3 (C21 H22 FN3 O3)

Compound Name

1-(2,5-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-3-methylpiperidine

IUPAC name

1-(25-dimethylfuran-3-carbonyl)-3-[5-(4-fluorophenyl)-124-oxadiazol-3-yl]-3-methylpiperidine

SMILES

CC(CCC1)(CN1C(c1c(C)oc(C)c1)=O)c1noc(-c(cc2)ccc2F)n1

InChI

InChI=1S/C21H22FN3O3/c1-13-11-17(14(2)27-13)19(26)25-10-4-9-21(3,12-25)20-23-18(28-24-20)15-5-7-16(22)8-6-15/h5-8,11H,4,9-10,12H2,1-3H3/t21-/m0/s1

InChI Key

PKAWPJOKTJMPTD-NRFANRHFSA-N

MDL Number (MFCD)

MFCD32001907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.968

Distribution Coefficient, logD

3.968

Water Solubility, LogSw

-4.09

Polar Surface Area

55.973

Acid Dissociation Constant (pKa)

26.79

Base Dissociation Constant (pKb)

-1.68

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with SA69-1153 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA69-1153?
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What is the minimum amount of SA69-1153 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA69-1153
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA69-1153
  • 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 SA69-1153 available by request