1094-0058 Screening compound: N'-[(3Z)-1-benzyl-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide

1094-0058 Screening compound: N'-[(3Z)-1-benzyl-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide
1094-0058 Screening compound: N'-[(3Z)-1-benzyl-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1094-0058
N'-[(3Z)-1-benzyl-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide

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

1094-0058

Molecular Formula

C23H18BrN3O2 (C23 H18 BrN3 O2)

Compound Name

N'-[(3Z)-1-benzyl-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide

IUPAC name

N'-[(3Z)-1-benzyl-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-3-methylbenzohydrazide

SMILES

Cc1cccc(C(N/N=C(/c(cc(cc2)Br)c2N2Cc3ccccc3)\C2=O)=O)c1

InChI

InChI=1S/C23H18BrN3O2/c1-15-6-5-9-17(12-15)22(28)26-25-21-19-13-18(24)10-11-20(19)27(23(21)29)14-16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,26,28)

InChI Key

AJANUQLDEMZKRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00336754

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.455

Distribution Coefficient, logD

4.754

Water Solubility, LogSw

-5.47

Polar Surface Area

49.589

Acid Dissociation Constant (pKa)

6.79

Base Dissociation Constant (pKb)

-3.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with 1094-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1094-0058?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1094-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1094-0058
  • 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 1094-0058 available by request