1648-3128 Screening compound: N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-3,4-dimethoxybenzohydrazide

1648-3128 Screening compound: N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-3,4-dimethoxybenzohydrazide
1648-3128 Screening compound: N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-3,4-dimethoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1648-3128
N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-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

1648-3128

Molecular Formula

C16H14BrN3O6 (C16 H14 BrN3 O6)

Compound Name

N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-3,4-dimethoxybenzohydrazide

IUPAC name

N'-[(Z)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-34-dimethoxybenzohydrazide

SMILES

COc(ccc(C(N/N=C\c1cc(Br)cc([N+]([O-])=O)c1O)=O)c1)c1OC

InChI

InChI=1S/C16H14BrN3O6/c1-25-13-4-3-9(6-14(13)26-2)16(22)19-18-8-10-5-11(17)7-12(15(10)21)20(23)24/h3-8,21H,1-2H3,(H,19,22)

InChI Key

MVEJEZPWVGPUAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01330016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.21

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.743

Distribution Coefficient, logD

2.905

Water Solubility, LogSw

-4.07

Polar Surface Area

99.375

Acid Dissociation Constant (pKa)

6.63

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

1648-3128 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1648-3128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1648-3128?
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What is the minimum amount of 1648-3128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1648-3128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1648-3128
  • 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 1648-3128 available by request