8005-7175 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 3,4,5-trimethoxybenzoate

8005-7175 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 3,4,5-trimethoxybenzoate
8005-7175 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 3,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-7175
2,4-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 3,4,5-trimethoxybenzoate

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

8005-7175

Molecular Formula

C26H24Br2N2O7 (C26 H24 Br2 N2 O7)

Compound Name

2,4-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 3,4,5-trimethoxybenzoate

IUPAC name

24-dibromo-6-[(E)-{[2-(2-methylphenoxy)acetamido]imino}methyl]phenyl 345-trimethoxybenzoate

SMILES

Cc(cccc1)c1OCC(N/N=C/c1cc(Br)cc(Br)c1OC(c(cc1OC)cc(OC)c1OC)=O)=O

InChI

InChI=1S/C26H24Br2N2O7/c1-15-7-5-6-8-20(15)36-14-23(31)30-29-13-17-9-18(27)12-19(28)24(17)37-26(32)16-10-21(33-2)25(35-4)22(11-16)34-3/h5-13H,14H2,1-4H3,(H,30,31)

InChI Key

INBVTFAWDZHTTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00787455

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

636.29

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.842

Distribution Coefficient, logD

5.804

Water Solubility, LogSw

-5.53

Polar Surface Area

86.456

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with 8005-7175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-7175?
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What is the minimum amount of 8005-7175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-7175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-7175
  • 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 8005-7175 available by request