K087-0451 Screening compound: N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(2,4-dichlorophenoxy)butanehydrazide

K087-0451 Screening compound: N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(2,4-dichlorophenoxy)butanehydrazide
K087-0451 Screening compound: N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(2,4-dichlorophenoxy)butanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K087-0451
N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(2,4-dichlorophenoxy)butanehydrazide

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

K087-0451

Molecular Formula

C25H22BrCl3N2O4 (C25 H22 BrCl3 N2 O4)

Compound Name

N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(2,4-dichlorophenoxy)butanehydrazide

IUPAC name

N'-[(E)-{3-bromo-4-[(2-chlorophenyl)methoxy]-5-methoxyphenyl}methylidene]-4-(24-dichlorophenoxy)butanehydrazide

SMILES

COc1cc(/C=N/NC(CCCOc(ccc(Cl)c2)c2Cl)=O)cc(Br)c1OCc(cccc1)c1Cl

InChI

InChI=1S/C25H22BrCl3N2O4/c1-33-23-12-16(11-19(26)25(23)35-15-17-5-2-3-6-20(17)28)14-30-31-24(32)7-4-10-34-22-9-8-18(27)13-21(22)29/h2-3,5-6,8-9,11-14H,4,7,10,15H2,1H3,(H,31,32)

InChI Key

MHCAWFDKAWBNSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01539065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

600.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.831

Distribution Coefficient, logD

6.829

Water Solubility, LogSw

-6.33

Polar Surface Area

57.876

Acid Dissociation Constant (pKa)

9.79

Base Dissociation Constant (pKb)

1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

K087-0451 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with K087-0451 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K087-0451?
Check Price and Availability of K087-0451, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K087-0451 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K087-0451
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K087-0451
  • 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 K087-0451 available by request