S713-0184 Screening compound: 1-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-4-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]piperidine

S713-0184 Screening compound: 1-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-4-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]piperidine
S713-0184 Screening compound: 1-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-4-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S713-0184
1-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-4-[3-(1-methyl-1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]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

S713-0184

Molecular Formula

C22H24N6O2 (C22 H24 N6 O2)

Compound Name

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

IUPAC name

1-[(3-benzyl-124-oxadiazol-5-yl)methyl]-4-[3-(1-methyl-1H-pyrrol-2-yl)-124-oxadiazol-5-yl]piperidine

SMILES

Cn1c(-c2noc(C3CCN(Cc4nc(Cc5ccccc5)no4)CC3)n2)ccc1

InChI

InChI=1S/C22H24N6O2/c1-27-11-5-8-18(27)21-24-22(30-26-21)17-9-12-28(13-10-17)15-20-23-19(25-29-20)14-16-6-3-2-4-7-16/h2-8,11,17H,9-10,12-15H2,1H3

InChI Key

LVKAKWLELLZBPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32226453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.239

Distribution Coefficient, logD

4.159

Water Solubility, LogSw

-4.13

Polar Surface Area

70.127

Acid Dissociation Constant (pKa)

26.27

Base Dissociation Constant (pKb)

6.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

References: we are preparing a list of scientific research reports with S713-0184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S713-0184?
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What is the minimum amount of S713-0184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S713-0184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S713-0184
  • 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 S713-0184 available by request