1189-1417 Screening compound: N'-[(3E)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]benzohydrazide

1189-1417 Screening compound: N'-[(3E)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]benzohydrazide
1189-1417 Screening compound: N'-[(3E)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1189-1417
N'-[(3E)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]benzohydrazide

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

1189-1417

Molecular Formula

C21H22BrN5O2 (C21 H22 BrN5 O2)

Compound Name

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

IUPAC name

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

SMILES

CN1CCN(CN(c(ccc(Br)c2)c2/C2=N\NC(c3ccccc3)=O)C2=O)CC1

InChI

InChI=1S/C21H22BrN5O2/c1-25-9-11-26(12-10-25)14-27-18-8-7-16(22)13-17(18)19(21(27)29)23-24-20(28)15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,24,28)

InChI Key

KEILZBBSFZSCHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00618825

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.34

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

2.968

Distribution Coefficient, logD

2.968

Water Solubility, LogSw

-3.58

Polar Surface Area

58.492

Acid Dissociation Constant (pKa)

6.92

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 1189-1417 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1189-1417?
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What is the minimum amount of 1189-1417 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1189-1417
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1189-1417
  • 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 1189-1417 available by request