1574-1708 Screening compound: 3-(furan-2-yl)-6H-spiro[[1,2,4]triazolo[3,4-a]isoquinoline-5,1'-cyclopentane]

1574-1708 Screening compound: 3-(furan-2-yl)-6H-spiro[[1,2,4]triazolo[3,4-a]isoquinoline-5,1'-cyclopentane]
1574-1708 Screening compound: 3-(furan-2-yl)-6H-spiro[[1,2,4]triazolo[3,4-a]isoquinoline-5,1'-cyclopentane] alternative view

Chemical Structure Depiction of ChemDiv screening compound 1574-1708
3-(furan-2-yl)-6H-spiro[[1,2,4]triazolo[3,4-a]isoquinoline-5,1'-cyclopentane]

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

1574-1708

Molecular Formula

C18H17N3O (C18 H17 N3 O)

Compound Name

3-(furan-2-yl)-6H-spiro[[1,2,4]triazolo[3,4-a]isoquinoline-5,1'-cyclopentane]

IUPAC name

3-(furan-2-yl)-6H-spiro[[124]triazolo[34-a]isoquinoline-51'-cyclopentane]

SMILES

C(CC1)CC1(Cc1c-2cccc1)n1c2nnc1-c1ccco1

InChI

InChI=1S/C18H17N3O/c1-2-7-14-13(6-1)12-18(9-3-4-10-18)21-16(14)19-20-17(21)15-8-5-11-22-15/h1-2,5-8,11H,3-4,9-10,12H2

InChI Key

BXCIERVECHLQHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00596354

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.261

Distribution Coefficient, logD

3.261

Water Solubility, LogSw

-3.53

Polar Surface Area

33.327

Acid Dissociation Constant (pKa)

24.22

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

1574-1708 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Frequent Hitters Library (7624 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
  • Agro
Structure:
  • Pool
  • Pool
  • Cyclic compounds
  • Cyclic compounds
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with 1574-1708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1574-1708?
Check Price and Availability of 1574-1708, 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 1574-1708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1574-1708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1574-1708
  • 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 1574-1708 available by request