2729-0453 Screening compound: 2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide

2729-0453 Screening compound: 2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide
2729-0453 Screening compound: 2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2729-0453
2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide

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

2729-0453

Molecular Formula

C18H14N4O6 (C18 H14 N4 O6)

Compound Name

2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide

IUPAC name

2-hydroxy-N'-[(E)-(2-hydroxy-5-methoxy-3-nitrophenyl)methylidene]quinoline-4-carbohydrazide

SMILES

COc(cc1/C=N/NC(c2cc(O)nc3ccccc23)=O)cc([N+]([O-])=O)c1O

InChI

InChI=1S/C18H14N4O6/c1-28-11-6-10(17(24)15(7-11)22(26)27)9-19-21-18(25)13-8-16(23)20-14-5-3-2-4-12(13)14/h2-9,24H,1H3,(H,20,23)(H,21,25)

InChI Key

MACLGDAFPGOGFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01951359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.33

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.264

Distribution Coefficient, logD

3.012

Water Solubility, LogSw

-3.69

Polar Surface Area

117.247

Acid Dissociation Constant (pKa)

7.50

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

References: we are preparing a list of scientific research reports with 2729-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2729-0453?
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What is the minimum amount of 2729-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2729-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2729-0453
  • 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 2729-0453 available by request