2236-0158 Screening compound: N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide

2236-0158 Screening compound: N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide
2236-0158 Screening compound: N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2236-0158
N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide

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

2236-0158

Molecular Formula

C17H19N3O (C17 H19 N3 O)

Compound Name

N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide

IUPAC name

N'-[(E)-(4-cyanophenyl)methylidene]-1-methylbicyclo[4.1.0]heptane-7-carbohydrazide

SMILES

CC1(C2CCCC1)C2C(N/N=C/c(cc1)ccc1C#N)=O

InChI

InChI=1S/C17H19N3O/c1-17-9-3-2-4-14(17)15(17)16(21)20-19-11-13-7-5-12(10-18)6-8-13/h5-8,11,14-15H,2-4,9H2,1H3,(H,20,21)

InChI Key

RKZAWWHRWQDNBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.160

Distribution Coefficient, logD

3.159

Water Solubility, LogSw

-3.16

Polar Surface Area

53.054

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

47.10

References: we are preparing a list of scientific research reports with 2236-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2236-0158?
Check Price and Availability of 2236-0158, 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 2236-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2236-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2236-0158
  • 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 2236-0158 available by request