Screening compound: IOJAUUKHPAFHIA-UHFFFAOYSA-N

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

Chemical Structure Depiction of ChemDiv screening compound
IOJAUUKHPAFHIA-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

P803-0001

Molecular Formula

C21H28N4O (C21 H28 N4 O)

Compound Name

1-cyclohexanecarbonyl-4-(3-phenyl-1H-pyrazol-5-yl)-1,4-diazepane

IUPAC name

1-cyclohexanecarbonyl-4-(3-phenyl-1H-pyrazol-5-yl)-14-diazepane

SMILES

O=C(C1CCCCC1)N(CCC1)CCN1c1cc(-c2ccccc2)n[nH]1

InChI

InChI=1S/C21H28N4O/c26-21(18-10-5-2-6-11-18)25-13-7-12-24(14-15-25)20-16-19(22-23-20)17-8-3-1-4-9-17/h1,3-4,8-9,16,18H,2,5-7,10-15H2,(H,22,23)

InChI Key

IOJAUUKHPAFHIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28121145

IOJAUUKHPAFHIA-UHFFFAOYSA-N in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

GPCR Targeted Library (31838 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators

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

Frequently Asked Questions

How to purchase chemical compound IOJAUUKHPAFHIA-UHFFFAOYSA-N?
Check Price and Availability of IOJAUUKHPAFHIA-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 IOJAUUKHPAFHIA-UHFFFAOYSA-N you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for IOJAUUKHPAFHIA-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 IOJAUUKHPAFHIA-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 IOJAUUKHPAFHIA-UHFFFAOYSA-N available by request