Screening compound: InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3

Screening compound: InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3
Screening compound: InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3

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

T744-0119

Molecular Formula

C14H16N2O4S (C14 H16 N2 O4 S)

Compound Name

3-methylbenzyl 2,5-dimethyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate

IUPAC name

(3-methylphenyl)methyl 25-dimethyl-11-dioxo-2H-1lambda626-thiadiazine-4-carboxylate

SMILES

Cc1cccc(COC(C(C(C)=N2)=CN(C)S2(=O)=O)=O)c1

InChI

InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3

InChI Key

IYOPUHCYMGCVAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623234

InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with InChI=1S/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3 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/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3
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/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3
  • 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/C14H16N2O4S/c1-10-5-4-6-12(7-10)9-20-14(17)13-8-16(3)21(18,19)15-11(13)2/h4-8H,9H2,1-3H3 available by request