8006-5440 Screening compound: 4-[(E)-[(3,4-dimethylphenyl)imino]methyl]-2-methoxyphenol

8006-5440 Screening compound: 4-[(E)-[(3,4-dimethylphenyl)imino]methyl]-2-methoxyphenol
8006-5440 Screening compound: 4-[(E)-[(3,4-dimethylphenyl)imino]methyl]-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-5440
4-[(E)-[(3,4-dimethylphenyl)imino]methyl]-2-methoxyphenol

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

8006-5440

Molecular Formula

C16H17NO2 (C16 H17 NO2)

Compound Name

4-[(E)-[(3,4-dimethylphenyl)imino]methyl]-2-methoxyphenol

IUPAC name

4-[(E)-[(34-dimethylphenyl)imino]methyl]-2-methoxyphenol

SMILES

Cc(cc1)c(C)cc1/N=C/c(cc1)cc(OC)c1O

InChI

InChI=1S/C16H17NO2/c1-11-4-6-14(8-12(11)2)17-10-13-5-7-15(18)16(9-13)19-3/h4-10,18H,1-3H3

InChI Key

DZERVNWKZUFQDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00556327

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

255.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.666

Distribution Coefficient, logD

3.640

Water Solubility, LogSw

-3.44

Polar Surface Area

32.544

Acid Dissociation Constant (pKa)

9.56

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8006-5440 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8006-5440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-5440?
Check Price and Availability of 8006-5440, 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 8006-5440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-5440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-5440
  • 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 8006-5440 available by request