SB57-0389 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-2-pyrazinyl)methanone

SB57-0389 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-2-pyrazinyl)methanone
SB57-0389 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-2-pyrazinyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB57-0389
[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-2-pyrazinyl)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

SB57-0389

Molecular Formula

C17H22N6O4S (C17 H22 N6 O4 S)

Compound Name

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

IUPAC name

6-(ethanesulfonyl)-8-(3-methyl-124-oxadiazol-5-yl)-2-(5-methylpyrazine-2-carbonyl)-26-diazaspiro[3.4]octane

SMILES

CCS(N(C1)CC(C2)(CN2C(c2ncc(C)nc2)=O)C1c1nc(C)no1)(=O)=O

InChI

InChI=1S/C17H22N6O4S/c1-4-28(25,26)23-7-13(15-20-12(3)21-27-15)17(10-23)8-22(9-17)16(24)14-6-18-11(2)5-19-14/h5-6,13H,4,7-10H2,1-3H3/t13-/m0/s1

InChI Key

HCNAFFKRKPNVKN-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD32249122

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.47

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.089

Distribution Coefficient, logD

-0.089

Water Solubility, LogSw

-1.45

Polar Surface Area

98.294

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.82

SB57-0389 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 SB57-0389 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB57-0389?
Check Price and Availability of SB57-0389, 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 SB57-0389 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB57-0389
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB57-0389
  • 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 SB57-0389 available by request