5682-0133 Screening compound: (2E)-5-bromo-4-chloro-2-{[(3-chlorophenyl)amino]methylidene}-2,3-dihydro-1H-indol-3-one

5682-0133 Screening compound: (2E)-5-bromo-4-chloro-2-{[(3-chlorophenyl)amino]methylidene}-2,3-dihydro-1H-indol-3-one
5682-0133 Screening compound: (2E)-5-bromo-4-chloro-2-{[(3-chlorophenyl)amino]methylidene}-2,3-dihydro-1H-indol-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5682-0133
(2E)-5-bromo-4-chloro-2-{[(3-chlorophenyl)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

5682-0133

Molecular Formula

C15H9BrCl2N2O (C15 H9 BrCl2 N2 O)

Compound Name

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

IUPAC name

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

SMILES

O=C1c(c(Cl)c(cc2)Br)c2N/C1=C/Nc1cc(Cl)ccc1

InChI

InChI=1S/C15H9BrCl2N2O/c16-10-4-5-11-13(14(10)18)15(21)12(20-11)7-19-9-3-1-2-8(17)6-9/h1-7,19-20H

InChI Key

KPONWMRPDPHJMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.06

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.404

Distribution Coefficient, logD

5.395

Water Solubility, LogSw

-6.20

Polar Surface Area

36.260

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 5682-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5682-0133?
Check Price and Availability of 5682-0133, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5682-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5682-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5682-0133
  • 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 5682-0133 available by request