SC88-1294 Screening compound: 2-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione

SC88-1294 Screening compound: 2-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
SC88-1294 Screening compound: 2-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound SC88-1294
2-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione

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

SC88-1294

Molecular Formula

C20H21N5O4S (C20 H21 N5 O4 S)

Compound Name

2-[(1-ethyl-1H-pyrazol-4-yl)carbonyl]-8-(3-phenyl-1,2,4-oxadiazol-5-yl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione

IUPAC name

2-(1-ethyl-1H-pyrazole-4-carbonyl)-8-(3-phenyl-124-oxadiazol-5-yl)-5lambda6-thia-2-azaspiro[3.4]octane-55-dione

SMILES

CCn1ncc(C(N(C2)CC2(C(CC2)c3nc(-c4ccccc4)no3)S2(=O)=O)=O)c1

InChI

InChI=1S/C20H21N5O4S/c1-2-25-11-15(10-21-25)19(26)24-12-20(13-24)16(8-9-30(20,27)28)18-22-17(23-29-18)14-6-4-3-5-7-14/h3-7,10-11,16H,2,8-9,12-13H2,1H3/t16-/m0/s1

InChI Key

OORDJGHGUZYXDP-INIZCTEOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.705

Distribution Coefficient, logD

1.705

Water Solubility, LogSw

-2.26

Polar Surface Area

91.805

Acid Dissociation Constant (pKa)

19.04

Base Dissociation Constant (pKb)

1.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with SC88-1294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC88-1294?
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What is the minimum amount of SC88-1294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC88-1294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC88-1294
  • 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 SC88-1294 available by request