Screening compound: InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2

Screening compound: InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2
Screening compound: InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2

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

E196-0328

Molecular Formula

C21H15FN4O3S (C21 H15 FN4 O3 S)

Compound Name

3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(2-fluorophenyl)methyl]sulfanyl}-3,4-dihydropteridin-4-one

IUPAC name

3-[(2H-13-benzodioxol-5-yl)methyl]-2-{[(2-fluorophenyl)methyl]sulfanyl}-34-dihydropteridin-4-one

SMILES

O=C1N(Cc(cc2)cc3c2OCO3)C(SCc(cccc2)c2F)=Nc2nccnc12

InChI

InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2

InChI Key

NPSDUPBMJJISPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14844781

InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Check Price and Availability of InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2
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/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2
  • 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/C21H15FN4O3S/c22-15-4-2-1-3-14(15)11-30-21-25-19-18(23-7-8-24-19)20(27)26(21)10-13-5-6-16-17(9-13)29-12-28-16/h1-9H,10-12H2 available by request