5682-0141 Screening compound: (2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-2,3-dihydro-1H-indol-3-one

5682-0141 Screening compound: (2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-2,3-dihydro-1H-indol-3-one
5682-0141 Screening compound: (2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-2,3-dihydro-1H-indol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5682-0141
(2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-2,3-dihydro-1H-indol-3-one

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

5682-0141

Molecular Formula

C16H11BrCl2N2O (C16 H11 BrCl2 N2 O)

Compound Name

(2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-2,3-dihydro-1H-indol-3-one

IUPAC name

(2E)-5-bromo-4-chloro-2-({[(2-chlorophenyl)methyl]amino}methylidene)-23-dihydro-1H-indol-3-one

SMILES

O=C1c(c(Cl)c(cc2)Br)c2N/C1=C/NCc(cccc1)c1Cl

InChI

InChI=1S/C16H11BrCl2N2O/c17-10-5-6-12-14(15(10)19)16(22)13(21-12)8-20-7-9-3-1-2-4-11(9)18/h1-6,8,20-21H,7H2

InChI Key

GQUVQMMHMGFOMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.09

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.743

Distribution Coefficient, logD

4.634

Water Solubility, LogSw

-5.10

Polar Surface Area

37.791

Acid Dissociation Constant (pKa)

7.94

Base Dissociation Constant (pKb)

4.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

5682-0141 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5682-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5682-0141?
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What is the minimum amount of 5682-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5682-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5682-0141
  • 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 5682-0141 available by request