2047-9699 Screening compound: (4Z)-2-(2,5-dichlorophenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

2047-9699 Screening compound: (4Z)-2-(2,5-dichlorophenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
2047-9699 Screening compound: (4Z)-2-(2,5-dichlorophenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2047-9699
(4Z)-2-(2,5-dichlorophenyl)-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

2047-9699

Molecular Formula

C18H13Cl2NO3 (C18 H13 Cl2 NO3)

Compound Name

(4Z)-2-(2,5-dichlorophenyl)-4-[(4-ethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(25-dichlorophenyl)-4-[(4-ethoxyphenyl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

CCOc1ccc(/C=C2\N=C(c(cc(cc3)Cl)c3Cl)OC2=O)cc1

InChI

InChI=1S/C18H13Cl2NO3/c1-2-23-13-6-3-11(4-7-13)9-16-18(22)24-17(21-16)14-10-12(19)5-8-15(14)20/h3-10H,2H2,1H3

InChI Key

HPRMEKURWSQNSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247625

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.21

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.829

Distribution Coefficient, logD

4.829

Water Solubility, LogSw

-4.95

Polar Surface Area

37.499

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 2047-9699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2047-9699?
Check Price and Availability of 2047-9699, 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 2047-9699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2047-9699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2047-9699
  • 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 2047-9699 available by request