K087-0209 Screening compound: 2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide

K087-0209 Screening compound: 2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide
K087-0209 Screening compound: 2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K087-0209
2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide

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

K087-0209

Molecular Formula

C26H25ClFN5O4 (C26 H25 ClFN5 O4)

Compound Name

2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide

IUPAC name

2-chloro-N'-[(E)-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)methylidene]-4-nitrobenzohydrazide

SMILES

COc1c(CN(CC2)CCN2c(cc2)ccc2F)cc(/C=N/NC(c(ccc([N+]([O-])=O)c2)c2Cl)=O)cc1

InChI

InChI=1S/C26H25ClFN5O4/c1-37-25-9-2-18(16-29-30-26(34)23-8-7-22(33(35)36)15-24(23)27)14-19(25)17-31-10-12-32(13-11-31)21-5-3-20(28)4-6-21/h2-9,14-16H,10-13,17H2,1H3,(H,30,34)

InChI Key

RUMZUWYRMOLICG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01539011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.773

Distribution Coefficient, logD

4.727

Water Solubility, LogSw

-5.06

Polar Surface Area

83.559

Acid Dissociation Constant (pKa)

8.72

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with K087-0209 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K087-0209?
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What is the minimum amount of K087-0209 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K087-0209
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K087-0209
  • 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 K087-0209 available by request