8003-5516 Screening compound: 2-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)phenol

8003-5516 Screening compound: 2-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)phenol
8003-5516 Screening compound: 2-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-5516
2-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)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

8003-5516

Molecular Formula

C31H30N2O2 (C31 H30 N2 O2)

Compound Name

2-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(2,3-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)phenol

IUPAC name

2-[(E)-[(23-dimethylphenyl)imino]methyl]-4-({3-[(E)-[(23-dimethylphenyl)imino]methyl]-4-hydroxyphenyl}methyl)phenol

SMILES

Cc1cccc(/N=C/c(cc(Cc(cc2)cc(/C=N/c3c(C)c(C)ccc3)c2O)cc2)c2O)c1C

InChI

InChI=1S/C31H30N2O2/c1-20-7-5-9-28(22(20)3)32-18-26-16-24(11-13-30(26)34)15-25-12-14-31(35)27(17-25)19-33-29-10-6-8-21(2)23(29)4/h5-14,16-19,34-35H,15H2,1-4H3

InChI Key

UJSAJCQIGWLCAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00744284

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.921

Distribution Coefficient, logD

7.893

Water Solubility, LogSw

-5.65

Polar Surface Area

47.922

Acid Dissociation Constant (pKa)

8.59

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.10

References: we are preparing a list of scientific research reports with 8003-5516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-5516?
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What is the minimum amount of 8003-5516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-5516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-5516
  • 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 8003-5516 available by request