SB57-0342 Screening compound: 1-[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl]-2-(3-methylphenyl)-1-ethanone

SB57-0342 Screening compound: 1-[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl]-2-(3-methylphenyl)-1-ethanone
SB57-0342 Screening compound: 1-[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl]-2-(3-methylphenyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB57-0342
1-[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl]-2-(3-methylphenyl)-1-ethanone

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

SB57-0342

Molecular Formula

C20H26N4O4S (C20 H26 N4 O4 S)

Compound Name

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

IUPAC name

1-[6-(ethanesulfonyl)-8-(3-methyl-124-oxadiazol-5-yl)-26-diazaspiro[3.4]octan-2-yl]-2-(3-methylphenyl)ethan-1-one

SMILES

CCS(N(C1)CC(C2)(CN2C(Cc2cc(C)ccc2)=O)C1c1nc(C)no1)(=O)=O

InChI

InChI=1S/C20H26N4O4S/c1-4-29(26,27)24-10-17(19-21-15(3)22-28-19)20(13-24)11-23(12-20)18(25)9-16-7-5-6-14(2)8-16/h5-8,17H,4,9-13H2,1-3H3/t17-/m0/s1

InChI Key

RPMAQYRHRJBMHG-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32248988

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.032

Distribution Coefficient, logD

2.032

Water Solubility, LogSw

-2.55

Polar Surface Area

79.685

Acid Dissociation Constant (pKa)

17.63

Base Dissociation Constant (pKb)

6.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.00

References: we are preparing a list of scientific research reports with SB57-0342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB57-0342?
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What is the minimum amount of SB57-0342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB57-0342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB57-0342
  • 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 SB57-0342 available by request