8003-2455 Screening compound: (3E)-N-(4-chlorophenyl)-3-{[2-(2,4-dibromo-5-methylphenoxy)acetamido]imino}butanamide

8003-2455 Screening compound: (3E)-N-(4-chlorophenyl)-3-{[2-(2,4-dibromo-5-methylphenoxy)acetamido]imino}butanamide
8003-2455 Screening compound: (3E)-N-(4-chlorophenyl)-3-{[2-(2,4-dibromo-5-methylphenoxy)acetamido]imino}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-2455
(3E)-N-(4-chlorophenyl)-3-{[2-(2,4-dibromo-5-methylphenoxy)acetamido]imino}butanamide

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

8003-2455

Molecular Formula

C19H18Br2ClN3O3 (C19 H18 Br2 ClN3 O3)

Compound Name

(3E)-N-(4-chlorophenyl)-3-{[2-(2,4-dibromo-5-methylphenoxy)acetamido]imino}butanamide

IUPAC name

(3E)-N-(4-chlorophenyl)-3-{[2-(24-dibromo-5-methylphenoxy)acetamido]imino}butanamide

SMILES

C/C(/CC(Nc(cc1)ccc1Cl)=O)=N\NC(COc(cc(C)c(Br)c1)c1Br)=O

InChI

InChI=1S/C19H18Br2ClN3O3/c1-11-7-17(16(21)9-15(11)20)28-10-19(27)25-24-12(2)8-18(26)23-14-5-3-13(22)4-6-14/h3-7,9H,8,10H2,1-2H3,(H,23,26)(H,25,27)

InChI Key

KEKPQFXCAMKALL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00734605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.024

Distribution Coefficient, logD

5.024

Water Solubility, LogSw

-5.09

Polar Surface Area

65.445

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

-0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with 8003-2455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-2455?
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What is the minimum amount of 8003-2455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-2455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-2455
  • 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 8003-2455 available by request