2159-0354 Screening compound: (2E)-N'-[2-(3,4-dimethylphenoxy)acetyl]-3-(4-methoxyphenyl)prop-2-enehydrazide

2159-0354 Screening compound: (2E)-N'-[2-(3,4-dimethylphenoxy)acetyl]-3-(4-methoxyphenyl)prop-2-enehydrazide
2159-0354 Screening compound: (2E)-N'-[2-(3,4-dimethylphenoxy)acetyl]-3-(4-methoxyphenyl)prop-2-enehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-0354
(2E)-N'-[2-(3,4-dimethylphenoxy)acetyl]-3-(4-methoxyphenyl)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

2159-0354

Molecular Formula

C20H22N2O4 (C20 H22 N2 O4)

Compound Name

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

IUPAC name

(2E)-N'-[2-(34-dimethylphenoxy)acetyl]-3-(4-methoxyphenyl)prop-2-enehydrazide

SMILES

Cc(cc1)c(C)cc1OCC(NNC(/C=C/c(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C20H22N2O4/c1-14-4-8-18(12-15(14)2)26-13-20(24)22-21-19(23)11-7-16-5-9-17(25-3)10-6-16/h4-12H,13H2,1-3H3,(H,21,23)(H,22,24)

InChI Key

ZRAFDTIJMZCOKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01180743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.670

Distribution Coefficient, logD

3.670

Water Solubility, LogSw

-3.90

Polar Surface Area

66.051

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-4.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

2159-0354 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 2159-0354 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-0354?
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What is the minimum amount of 2159-0354 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-0354
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-0354
  • 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 2159-0354 available by request