SB57-0313 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-3-pyridyl)methanone

SB57-0313 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-3-pyridyl)methanone
SB57-0313 Screening compound: [6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-3-pyridyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SB57-0313
[6-(ethylsulfonyl)-8-(3-methyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]oct-2-yl](5-methyl-3-pyridyl)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

SB57-0313

Molecular Formula

C18H23N5O4S (C18 H23 N5 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-3-pyridyl)methanone

IUPAC name

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

SMILES

CCS(N(C1)CC(C2)(CN2C(c2cncc(C)c2)=O)C1c1nc(C)no1)(=O)=O

InChI

InChI=1S/C18H23N5O4S/c1-4-28(25,26)23-8-15(16-20-13(3)21-27-16)18(11-23)9-22(10-18)17(24)14-5-12(2)6-19-7-14/h5-7,15H,4,8-11H2,1-3H3/t15-/m0/s1

InChI Key

VEEWCLQMBLEHRU-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD32248881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.48

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.286

Distribution Coefficient, logD

0.286

Water Solubility, LogSw

-1.62

Polar Surface Area

89.820

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

References: we are preparing a list of scientific research reports with SB57-0313 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB57-0313?
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What is the minimum amount of SB57-0313 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB57-0313
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB57-0313
  • 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 SB57-0313 available by request