4072-2893 Screening compound: N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide

4072-2893 Screening compound: N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide
4072-2893 Screening compound: N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4072-2893
N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide

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

4072-2893

Molecular Formula

C31H27BrN4O3 (C31 H27 BrN4 O3)

Compound Name

N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide

IUPAC name

N'-[(3Z)-5-bromo-1-[(dibenzylamino)methyl]-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-methoxybenzohydrazide

SMILES

COc(cccc1)c1C(N/N=C(/c(cc(cc1)Br)c1N1CN(Cc2ccccc2)Cc2ccccc2)\C1=O)=O

InChI

InChI=1S/C31H27BrN4O3/c1-39-28-15-9-8-14-25(28)30(37)34-33-29-26-18-24(32)16-17-27(26)36(31(29)38)21-35(19-22-10-4-2-5-11-22)20-23-12-6-3-7-13-23/h2-18H,19-21H2,1H3,(H,34,37)

InChI Key

ROQZOCXXIBHFES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

583.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.190

Distribution Coefficient, logD

4.424

Water Solubility, LogSw

-5.53

Polar Surface Area

62.354

Acid Dissociation Constant (pKa)

5.79

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.90

References: we are preparing a list of scientific research reports with 4072-2893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4072-2893?
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What is the minimum amount of 4072-2893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4072-2893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4072-2893
  • 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 4072-2893 available by request