Screening compound: InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2

Screening compound: InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2
Screening compound: InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2

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

D727-0654

Molecular Formula

C18H12BrN3O3S (C18 H12 BrN3 O3 S)

Compound Name

3-[(2H-1,3-benzodioxol-5-yloxy)methyl]-6-(4-bromophenyl)-[1,2,4]triazolo[3,4-b][1,3]thiazole

IUPAC name

3-[(2H-13-benzodioxol-5-yloxy)methyl]-6-(4-bromophenyl)-[124]triazolo[34-b][13]thiazole

SMILES

Brc(cc1)ccc1-c(s1)cn2c1nnc2COc(cc1)cc2c1OCO2

InChI

InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2

InChI Key

YBRHQWVVVRJKTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14280083

InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2
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/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2
  • 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/C18H12BrN3O3S/c19-12-3-1-11(2-4-12)16-8-22-17(20-21-18(22)26-16)9-23-13-5-6-14-15(7-13)25-10-24-14/h1-8H,9-10H2 available by request