1140-0130 Screening compound: 3,4-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-methoxyphenol

1140-0130 Screening compound: 3,4-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-methoxyphenol
1140-0130 Screening compound: 3,4-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1140-0130
3,4-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-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

1140-0130

Molecular Formula

C18H19Br2NO3 (C18 H19 Br2 NO3)

Compound Name

3,4-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-methoxyphenol

IUPAC name

34-dibromo-2-[(E)-[(4-tert-butyl-2-hydroxyphenyl)imino]methyl]-6-methoxyphenol

SMILES

CC(C)(C)c(cc1)cc(O)c1/N=C/c(c(Br)c(cc1OC)Br)c1O

InChI

InChI=1S/C18H19Br2NO3/c1-18(2,3)10-5-6-13(14(22)7-10)21-9-11-16(20)12(19)8-15(24-4)17(11)23/h5-9,22-23H,1-4H3

InChI Key

NHYPDDGVOXLSMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00807023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.16

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.539

Distribution Coefficient, logD

5.071

Water Solubility, LogSw

-5.30

Polar Surface Area

47.326

Acid Dissociation Constant (pKa)

7.11

Base Dissociation Constant (pKb)

4.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with 1140-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1140-0130?
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What is the minimum amount of 1140-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1140-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1140-0130
  • 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 1140-0130 available by request