0077-0007 Screening compound: 2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol

0077-0007 Screening compound: 2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol
0077-0007 Screening compound: 2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0077-0007
2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol

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

0077-0007

Molecular Formula

C24H33NO2 (C24 H33 NO2)

Compound Name

2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol

IUPAC name

2-[(E)-[(4-butylphenyl)imino]methyl]-5-(heptyloxy)phenol

SMILES

CCCCCCCOc1cc(O)c(/C=N/c2ccc(CCCC)cc2)cc1

InChI

InChI=1S/C24H33NO2/c1-3-5-7-8-9-17-27-23-16-13-21(24(26)18-23)19-25-22-14-11-20(12-15-22)10-6-4-2/h11-16,18-19,26H,3-10,17H2,1-2H3

InChI Key

RYSKDYWXDPIPOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00982035

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.53

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.299

Distribution Coefficient, logD

8.279

Water Solubility, LogSw

-5.58

Polar Surface Area

32.332

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

4.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.80

0077-0007 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0077-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0077-0007?
Check Price and Availability of 0077-0007, 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 0077-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0077-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0077-0007
  • 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 0077-0007 available by request