2159-2658 Screening compound: (2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide

2159-2658 Screening compound: (2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide
2159-2658 Screening compound: (2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-2658
(2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide

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

2159-2658

Molecular Formula

C18H17N3O6 (C18 H17 N3 O6)

Compound Name

(2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide

IUPAC name

(2E)-3-(4-methoxyphenyl)-N'-[2-(4-nitrophenoxy)acetyl]prop-2-enehydrazide

SMILES

COc1ccc(/C=C/C(NNC(COc(cc2)ccc2[N+]([O-])=O)=O)=O)cc1

InChI

InChI=1S/C18H17N3O6/c1-26-15-7-2-13(3-8-15)4-11-17(22)19-20-18(23)12-27-16-9-5-14(6-10-16)21(24)25/h2-11H,12H2,1H3,(H,19,22)(H,20,23)

InChI Key

URQXCGRLLLWQIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01183786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.35

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.560

Distribution Coefficient, logD

2.559

Water Solubility, LogSw

-2.86

Polar Surface Area

99.432

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

2159-2658 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 2159-2658 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-2658?
Check Price and Availability of 2159-2658, 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 2159-2658 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-2658
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-2658
  • 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 2159-2658 available by request