4338-2263 Screening compound: (2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid

4338-2263 Screening compound: (2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid
4338-2263 Screening compound: (2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 4338-2263
(2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid

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

4338-2263

Molecular Formula

C22H23NO5 (C22 H23 NO5)

Compound Name

(2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid

IUPAC name

(2E)-3-{3-ethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-(phenylformamido)prop-2-enoic acid

SMILES

CCOc(cc(/C=C(\C(O)=O)/NC(c1ccccc1)=O)cc1)c1OCC(C)=C

InChI

InChI=1S/C22H23NO5/c1-4-27-20-13-16(10-11-19(20)28-14-15(2)3)12-18(22(25)26)23-21(24)17-8-6-5-7-9-17/h5-13H,2,4,14H2,1,3H3,(H,23,24)(H,25,26)

InChI Key

XQFFZOKMMKHVKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03196818

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.278

Distribution Coefficient, logD

-0.823

Water Solubility, LogSw

-3.33

Polar Surface Area

65.367

Acid Dissociation Constant (pKa)

3.30

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

4338-2263 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4338-2263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4338-2263?
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What is the minimum amount of 4338-2263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4338-2263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4338-2263
  • 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 4338-2263 available by request