Screening compound: PFOIICAKINQQIF-UHFFFAOYSA-N

Screening compound: PFOIICAKINQQIF-UHFFFAOYSA-N
Screening compound: PFOIICAKINQQIF-UHFFFAOYSA-N alternative view

Chemical Structure Depiction of ChemDiv screening compound
PFOIICAKINQQIF-UHFFFAOYSA-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

E213-0416

Molecular Formula

C22H25N3O2S (C22 H25 N3 O2 S)

Compound Name

N~2~-(2-ethylphenyl)-N~2~,3-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide

IUPAC name

N-(2-ethylphenyl)-N4-dimethyl-2-oxo-6-thia-18-diazatricyclo[7.5.0.0^{37}]tetradeca-3(7)48-triene-5-carboxamide

SMILES

CCc(cccc1)c1N(C)C(c1c(C)c(C(N(CCCCC2)C2=N2)=O)c2s1)=O

InChI

InChI=1S/C22H25N3O2S/c1-4-15-10-7-8-11-16(15)24(3)22(27)19-14(2)18-20(28-19)23-17-12-6-5-9-13-25(17)21(18)26/h7-8,10-11H,4-6,9,12-13H2,1-3H3

InChI Key

PFOIICAKINQQIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14847147

PFOIICAKINQQIF-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Purinergic Library (3321 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Recognition Elements PPI Library (24135 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels

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

Frequently Asked Questions

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