Screening compound: InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3

Screening compound: InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3
Screening compound: InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3

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

8012-4591

Molecular Formula

C18H13F3N4S (C18 H13 F3 N4 S)

Compound Name

5-methyl-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[1,2,4]triazino[5,6-b]indole

IUPAC name

5-methyl-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-5H-[124]triazino[56-b]indole

SMILES

Cn1c2nc(SCc3cc(C(F)(F)F)ccc3)nnc2c2c1cccc2

InChI

InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3

InChI Key

BFLIYQNEFPITSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03017722

InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with InChI=1S/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3 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/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3
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/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3
  • 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/C18H13F3N4S/c1-25-14-8-3-2-7-13(14)15-16(25)22-17(24-23-15)26-10-11-5-4-6-12(9-11)18(19,20)21/h2-9H,10H2,1H3 available by request