K088-0913 Screening compound: (4E)-2-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

K088-0913 Screening compound: (4E)-2-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
K088-0913 Screening compound: (4E)-2-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K088-0913
(4E)-2-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)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

K088-0913

Molecular Formula

C19H16ClNO5 (C19 H16 ClNO5)

Compound Name

(4E)-2-(4-chlorophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4E)-2-(4-chlorophenyl)-4-[(345-trimethoxyphenyl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

COc1cc(/C=C2/N=C(c(cc3)ccc3Cl)OC2=O)cc(OC)c1OC

InChI

InChI=1S/C19H16ClNO5/c1-23-15-9-11(10-16(24-2)17(15)25-3)8-14-19(22)26-18(21-14)12-4-6-13(20)7-5-12/h4-10H,1-3H3

InChI Key

PFAPAMIMZMHFGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01085402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.79

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

3.642

Distribution Coefficient, logD

3.642

Water Solubility, LogSw

-4.40

Polar Surface Area

53.353

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

K088-0913 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with K088-0913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K088-0913?
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What is the minimum amount of K088-0913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K088-0913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K088-0913
  • 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 K088-0913 available by request