3126-2184 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide

3126-2184 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide
3126-2184 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3126-2184
N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide

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

3126-2184

Molecular Formula

C21H21BrClN5O2 (C21 H21 BrClN5 O2)

Compound Name

N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide

IUPAC name

N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-chlorobenzohydrazide

SMILES

CN1CCN(CN(c(ccc(Br)c2)c2/C2=N/NC(c(cccc3)c3Cl)=O)C2=O)CC1

InChI

InChI=1S/C21H21BrClN5O2/c1-26-8-10-27(11-9-26)13-28-18-7-6-14(22)12-16(18)19(21(28)30)24-25-20(29)15-4-2-3-5-17(15)23/h2-7,12H,8-11,13H2,1H3,(H,25,29)

InChI Key

JDCRPIKZZRFSOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02224810

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.79

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.381

Distribution Coefficient, logD

3.381

Water Solubility, LogSw

-3.69

Polar Surface Area

58.492

Acid Dissociation Constant (pKa)

5.98

Base Dissociation Constant (pKb)

9.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 3126-2184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3126-2184?
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What is the minimum amount of 3126-2184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3126-2184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3126-2184
  • 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 3126-2184 available by request