K088-3057 Screening compound: (4E)-2-(3-bromo-4-methoxyphenyl)-4-[(2,3-dimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

K088-3057 Screening compound: (4E)-2-(3-bromo-4-methoxyphenyl)-4-[(2,3-dimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
K088-3057 Screening compound: (4E)-2-(3-bromo-4-methoxyphenyl)-4-[(2,3-dimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K088-3057
(4E)-2-(3-bromo-4-methoxyphenyl)-4-[(2,3-dimethoxyphenyl)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

K088-3057

Molecular Formula

C19H16BrNO5 (C19 H16 BrNO5)

Compound Name

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

IUPAC name

(4E)-2-(3-bromo-4-methoxyphenyl)-4-[(23-dimethoxyphenyl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

COc(ccc(C(OC1=O)=N/C1=C/c(cccc1OC)c1OC)c1)c1Br

InChI

InChI=1S/C19H16BrNO5/c1-23-15-8-7-12(9-13(15)20)18-21-14(19(22)26-18)10-11-5-4-6-16(24-2)17(11)25-3/h4-10H,1-3H3

InChI Key

NXPOTSPPXSEDRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533579

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.785

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.26

Polar Surface Area

53.353

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with K088-3057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K088-3057?
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What is the minimum amount of K088-3057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K088-3057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K088-3057
  • 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 K088-3057 available by request