8003-2151 Screening compound: (3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)butanamide

8003-2151 Screening compound: (3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)butanamide
8003-2151 Screening compound: (3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-2151
(3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)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

8003-2151

Molecular Formula

C20H21BrClN3O3 (C20 H21 BrClN3 O3)

Compound Name

(3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)butanamide

IUPAC name

(3E)-3-{[2-(4-bromo-2-methylphenoxy)acetamido]imino}-N-(5-chloro-2-methylphenyl)butanamide

SMILES

C/C(/CC(Nc1c(C)ccc(Cl)c1)=O)=N\NC(COc(cc1)c(C)cc1Br)=O

InChI

InChI=1S/C20H21BrClN3O3/c1-12-4-6-16(22)10-17(12)23-19(26)9-14(3)24-25-20(27)11-28-18-7-5-15(21)8-13(18)2/h4-8,10H,9,11H2,1-3H3,(H,23,26)(H,25,27)

InChI Key

XQCCZIWHTXOPLK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00743117

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.76

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

4.490

Distribution Coefficient, logD

4.490

Water Solubility, LogSw

-4.50

Polar Surface Area

64.747

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 8003-2151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-2151?
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What is the minimum amount of 8003-2151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-2151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-2151
  • 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 8003-2151 available by request