5618-0177 Screening compound: (4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-4,5-dihydro-1,2-oxazol-5-one

5618-0177 Screening compound: (4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-4,5-dihydro-1,2-oxazol-5-one
5618-0177 Screening compound: (4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-4,5-dihydro-1,2-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5618-0177
(4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-4,5-dihydro-1,2-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

5618-0177

Molecular Formula

C19H16BrNO4 (C19 H16 BrNO4)

Compound Name

(4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-4,5-dihydro-1,2-oxazol-5-one

IUPAC name

(4Z)-4-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-3-phenyl-45-dihydro-12-oxazol-5-one

SMILES

CCOc(c(OC)cc(/C=C(/C(c1ccccc1)=NO1)\C1=O)c1)c1Br

InChI

InChI=1S/C19H16BrNO4/c1-3-24-18-15(20)10-12(11-16(18)23-2)9-14-17(21-25-19(14)22)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3

InChI Key

FVSAKGUHEBBIBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03994642

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.24

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

4.120

Distribution Coefficient, logD

4.120

Water Solubility, LogSw

-4.27

Polar Surface Area

50.619

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-5.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

5618-0177 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 5618-0177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5618-0177?
Check Price and Availability of 5618-0177, 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 5618-0177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5618-0177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5618-0177
  • 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 5618-0177 available by request