2180-0097 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide

2180-0097 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide
2180-0097 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2180-0097
N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide

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

2180-0097

Molecular Formula

C17H14BrN3O4 (C17 H14 BrN3 O4)

Compound Name

N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide

IUPAC name

N'-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-(4-methoxyphenoxy)acetohydrazide

SMILES

COc(cc1)ccc1OCC(N/N=C(\c(cc(cc1)Br)c1N1)/C1=O)=O

InChI

InChI=1S/C17H14BrN3O4/c1-24-11-3-5-12(6-4-11)25-9-15(22)20-21-16-13-8-10(18)2-7-14(13)19-17(16)23/h2-8H,9H2,1H3,(H,20,22)(H,19,21,23)

InChI Key

PRXFQUOXQBLGBA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01537752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.218

Distribution Coefficient, logD

3.172

Water Solubility, LogSw

-3.61

Polar Surface Area

74.194

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with 2180-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2180-0097?
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What is the minimum amount of 2180-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2180-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2180-0097
  • 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 2180-0097 available by request