3126-2394 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3,4-dimethoxybenzohydrazide

3126-2394 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3,4-dimethoxybenzohydrazide
3126-2394 Screening compound: N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3,4-dimethoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3126-2394
N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3,4-dimethoxybenzohydrazide

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

3126-2394

Molecular Formula

C23H26BrN5O4 (C23 H26 BrN5 O4)

Compound Name

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

IUPAC name

N'-[(3Z)-5-bromo-1-[(4-methylpiperazin-1-yl)methyl]-2-oxo-23-dihydro-1H-indol-3-ylidene]-34-dimethoxybenzohydrazide

SMILES

CN1CCN(CN(c(ccc(Br)c2)c2/C2=N/NC(c(cc3)cc(OC)c3OC)=O)C2=O)CC1

InChI

InChI=1S/C23H26BrN5O4/c1-27-8-10-28(11-9-27)14-29-18-6-5-16(24)13-17(18)21(23(29)31)25-26-22(30)15-4-7-19(32-2)20(12-15)33-3/h4-7,12-13H,8-11,14H2,1-3H3,(H,26,30)

InChI Key

PEXVUTQPCSOVDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02224824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

516.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.697

Distribution Coefficient, logD

0.787

Water Solubility, LogSw

-3.22

Polar Surface Area

73.753

Acid Dissociation Constant (pKa)

7.84

Base Dissociation Constant (pKb)

9.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with 3126-2394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3126-2394?
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What is the minimum amount of 3126-2394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3126-2394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3126-2394
  • 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 3126-2394 available by request