Screening compound: InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3

Screening compound: InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3
Screening compound: InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3

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

S342-0429

Molecular Formula

C16H14N4O7S (C16 H14 N4 O7 S)

Compound Name

[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate

IUPAC name

[3-(2H-13-benzodioxol-5-yl)-124-oxadiazol-5-yl]methyl 25-dimethyl-11-dioxo-2H-1lambda626-thiadiazine-4-carboxylate

SMILES

CC(C(C(OCc1nc(-c(cc2)cc3c2OCO3)no1)=O)=CN1C)=NS1(=O)=O

InChI

InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3

InChI Key

NJMCSNVVHGYEOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29001877

InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

MEF2-HDAC (class II) Modulators Library (5147 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3
  • 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 InChI=1S/C16H14N4O7S/c1-9-11(6-20(2)28(22,23)19-9)16(21)24-7-14-17-15(18-27-14)10-3-4-12-13(5-10)26-8-25-12/h3-6H,7-8H2,1-2H3 available by request