6234-0730 Screening compound: 2-amino-6-(2,3-dimethoxyphenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

6234-0730 Screening compound: 2-amino-6-(2,3-dimethoxyphenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
6234-0730 Screening compound: 2-amino-6-(2,3-dimethoxyphenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 6234-0730
2-amino-6-(2,3-dimethoxyphenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

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

6234-0730

Molecular Formula

C19H22N4O4 (C19 H22 N4 O4)

Compound Name

2-amino-6-(2,3-dimethoxyphenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

IUPAC name

2-amino-6-(23-dimethoxyphenyl)-44-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-15-dicarbonitrile

SMILES

CCOC(C(C1c(cccc2OC)c2OC)(C11C#N)C#N)(N=C1N)OCC

InChI

InChI=1S/C19H22N4O4/c1-5-26-19(27-6-2)18(11-21)15(17(18,10-20)16(22)23-19)12-8-7-9-13(24-3)14(12)25-4/h7-9,15H,5-6H2,1-4H3,(H2,22,23)

InChI Key

ILNQKEXJJYZMNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04097228

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.432

Distribution Coefficient, logD

-0.155

Water Solubility, LogSw

-2.59

Polar Surface Area

93.686

Acid Dissociation Constant (pKa)

16.24

Base Dissociation Constant (pKb)

9.99

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

52.60

6234-0730 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 6234-0730 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6234-0730?
Check Price and Availability of 6234-0730, 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 6234-0730 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6234-0730
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6234-0730
  • 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 6234-0730 available by request