5008-0225 Screening compound: N-[(1E,2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine

5008-0225 Screening compound: N-[(1E,2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine
5008-0225 Screening compound: N-[(1E,2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5008-0225
N-[(1E,2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine

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

5008-0225

Molecular Formula

C11H13NO2 (C11 H13 NO2)

Compound Name

N-[(1E,2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine

IUPAC name

N-[(1E2Z)-2-[(furan-2-yl)methylidene]cyclohexylidene]hydroxylamine

SMILES

O/N=C(\CCCC1)/C1=C\c1ccco1

InChI

InChI=1S/C11H13NO2/c13-12-11-6-2-1-4-9(11)8-10-5-3-7-14-10/h3,5,7-8,13H,1-2,4,6H2

InChI Key

BAXQDIGRTXHTMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03448213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

191.23

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.080

Distribution Coefficient, logD

2.080

Water Solubility, LogSw

-2.05

Polar Surface Area

37.114

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

5008-0225 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5008-0225 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5008-0225?
Check Price and Availability of 5008-0225, 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 5008-0225 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5008-0225
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5008-0225
  • 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 5008-0225 available by request