K088-1733 Screening compound: 2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(2,3-dichlorophenyl)ethenyl]-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene]methyl}phenyl acetate

K088-1733 Screening compound: 2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(2,3-dichlorophenyl)ethenyl]-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene]methyl}phenyl acetate
K088-1733 Screening compound: 2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(2,3-dichlorophenyl)ethenyl]-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene]methyl}phenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K088-1733
2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(2,3-dichlorophenyl)ethenyl]-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene]methyl}phenyl acetate

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

K088-1733

Molecular Formula

C22H15Cl2NO6 (C22 H15 Cl2 NO6)

Compound Name

2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(2,3-dichlorophenyl)ethenyl]-5-oxo-4,5-dihydro-1,3-oxazol-4-ylidene]methyl}phenyl acetate

IUPAC name

2-(acetyloxy)-4-{[(4Z)-2-[(1E)-2-(23-dichlorophenyl)ethenyl]-5-oxo-45-dihydro-13-oxazol-4-ylidene]methyl}phenyl acetate

SMILES

CC(Oc(ccc(/C=C1\N=C(/C=C/c2cccc(Cl)c2Cl)OC1=O)c1)c1OC(C)=O)=O

InChI

InChI=1S/C22H15Cl2NO6/c1-12(26)29-18-8-6-14(11-19(18)30-13(2)27)10-17-22(28)31-20(25-17)9-7-15-4-3-5-16(23)21(15)24/h3-11H,1-2H3

InChI Key

OVLIJWRTRBCOAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02088213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.27

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.699

Distribution Coefficient, logD

4.699

Water Solubility, LogSw

-5.19

Polar Surface Area

72.197

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

-2.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with K088-1733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K088-1733?
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What is the minimum amount of K088-1733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K088-1733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K088-1733
  • 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 K088-1733 available by request