1894-8840 Screening compound: (4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

1894-8840 Screening compound: (4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
1894-8840 Screening compound: (4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1894-8840
(4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

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

1894-8840

Molecular Formula

C19H16ClNO4 (C19 H16 ClNO4)

Compound Name

(4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4E)-2-(5-chloro-2-methoxyphenyl)-4-[(4-ethoxyphenyl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

CCOc1ccc(/C=C2/N=C(c(cc(cc3)Cl)c3OC)OC2=O)cc1

InChI

InChI=1S/C19H16ClNO4/c1-3-24-14-7-4-12(5-8-14)10-16-19(22)25-18(21-16)15-11-13(20)6-9-17(15)23-2/h4-11H,3H2,1-2H3

InChI Key

MZCKDCXMYULSSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.79

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.110

Distribution Coefficient, logD

4.110

Water Solubility, LogSw

-4.74

Polar Surface Area

45.130

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 1894-8840 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1894-8840?
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What is the minimum amount of 1894-8840 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1894-8840
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1894-8840
  • 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 1894-8840 available by request