SB57-1065 Screening compound: [6-benzyl-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](1-methyl-1H-imidazol-5-yl)methanone

SB57-1065 Screening compound: [6-benzyl-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](1-methyl-1H-imidazol-5-yl)methanone
SB57-1065 Screening compound: [6-benzyl-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](1-methyl-1H-imidazol-5-yl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB57-1065
[6-benzyl-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](1-methyl-1H-imidazol-5-yl)methanone

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

SB57-1065

Molecular Formula

C21H24N6O2 (C21 H24 N6 O2)

Compound Name

[6-benzyl-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](1-methyl-1H-imidazol-5-yl)methanone

IUPAC name

6-benzyl-8-(3-methyl-124-oxadiazol-5-yl)-2-(1-methyl-1H-imidazole-5-carbonyl)-26-diazaspiro[3.4]octane

SMILES

Cc1noc(C2C(C3)(CN3C(c3cncn3C)=O)CN(Cc3ccccc3)C2)n1

InChI

InChI=1S/C21H24N6O2/c1-15-23-19(29-24-15)17-10-26(9-16-6-4-3-5-7-16)11-21(17)12-27(13-21)20(28)18-8-22-14-25(18)2/h3-8,14,17H,9-13H2,1-2H3/t17-/m1/s1

InChI Key

WGGLWLHMNQBUAR-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD32248727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.111

Distribution Coefficient, logD

-2.769

Water Solubility, LogSw

-1.34

Polar Surface Area

63.315

Acid Dissociation Constant (pKa)

26.02

Base Dissociation Constant (pKb)

11.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

SB57-1065 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SB57-1065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB57-1065?
Check Price and Availability of SB57-1065, 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 SB57-1065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB57-1065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB57-1065
  • 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 SB57-1065 available by request