6234-0350 Screening compound: 2-amino-4,4-diethoxy-6-(2-methylphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

6234-0350 Screening compound: 2-amino-4,4-diethoxy-6-(2-methylphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
6234-0350 Screening compound: 2-amino-4,4-diethoxy-6-(2-methylphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 6234-0350
2-amino-4,4-diethoxy-6-(2-methylphenyl)-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

6234-0350

Molecular Formula

C18H20N4O2 (C18 H20 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

CCOC(C(C1c2c(C)cccc2)(C11C#N)C#N)(N=C1N)OCC

InChI

InChI=1S/C18H20N4O2/c1-4-23-18(24-5-2)17(11-20)14(13-9-7-6-8-12(13)3)16(17,10-19)15(21)22-18/h6-9,14H,4-5H2,1-3H3,(H2,21,22)

InChI Key

ZRYQSMSNNDYECM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04096850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.996

Distribution Coefficient, logD

-0.696

Water Solubility, LogSw

-2.93

Polar Surface Area

78.338

Acid Dissociation Constant (pKa)

15.87

Base Dissociation Constant (pKb)

11.09

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

50.00

6234-0350 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 6234-0350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6234-0350?
Check Price and Availability of 6234-0350, 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 6234-0350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6234-0350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6234-0350
  • 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 6234-0350 available by request