4111-0483 Screening compound: N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide

4111-0483 Screening compound: N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide
4111-0483 Screening compound: N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4111-0483
N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide

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

4111-0483

Molecular Formula

C19H24N2O2 (C19 H24 N2 O2)

Compound Name

N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide

IUPAC name

N'-[(1E)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ylidene]-2-(4-methylphenoxy)acetohydrazide

SMILES

CC(C(CC=C1C)C/C1=N\NC(COc1ccc(C)cc1)=O)=C

InChI

InChI=1S/C19H24N2O2/c1-13(2)16-8-7-15(4)18(11-16)20-21-19(22)12-23-17-9-5-14(3)6-10-17/h5-7,9-10,16H,1,8,11-12H2,2-4H3,(H,21,22)/t16-/m1/s1

InChI Key

VEDADSDCXQAJLF-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD02603153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.777

Distribution Coefficient, logD

4.762

Water Solubility, LogSw

-4.42

Polar Surface Area

42.334

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

5.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

4111-0483 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4111-0483 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4111-0483?
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What is the minimum amount of 4111-0483 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4111-0483
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4111-0483
  • 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 4111-0483 available by request