Screening compound: KJQRCGIYYNNVIH-NEPJUHHUSA-N

Screening compound: KJQRCGIYYNNVIH-NEPJUHHUSA-N
Screening compound: KJQRCGIYYNNVIH-NEPJUHHUSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
KJQRCGIYYNNVIH-NEPJUHHUSA-N

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

S232-0396

Molecular Formula

C13H20N2O3S2 (C13 H20 N2 O3 S2)

Compound Name

1-methyl-8-(thiophene-2-sulfonyl)-decahydropyrido[3,4-e][1,4]oxazepine

IUPAC name

(5aS9aS)-1-methyl-8-(thiophene-2-sulfonyl)-decahydropyrido[34-e][14]oxazepine

SMILES

CN1[C@@H](CN(CC2)S(c3cccs3)(=O)=O)[C@@H]2COCC1

InChI

InChI=1S/C13H20N2O3S2/c1-14-6-7-18-10-11-4-5-15(9-12(11)14)20(16,17)13-3-2-8-19-13/h2-3,8,11-12H,4-7,9-10H2,1H3/t11-,12+/m1/s1

InChI Key

KJQRCGIYYNNVIH-NEPJUHHUSA-N

MDL Number (MFCD)

KJQRCGIYYNNVIH-NEPJUHHUSA-N in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with KJQRCGIYYNNVIH-NEPJUHHUSA-N chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound KJQRCGIYYNNVIH-NEPJUHHUSA-N?
Check Price and Availability of KJQRCGIYYNNVIH-NEPJUHHUSA-N, 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.
What is the minimum amount of KJQRCGIYYNNVIH-NEPJUHHUSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for KJQRCGIYYNNVIH-NEPJUHHUSA-N
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for KJQRCGIYYNNVIH-NEPJUHHUSA-N
  • 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 KJQRCGIYYNNVIH-NEPJUHHUSA-N available by request