1967-9201 Screening compound: (4Z)-4-(phenylmethylidene)-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,3-oxazol-5-one

1967-9201 Screening compound: (4Z)-4-(phenylmethylidene)-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,3-oxazol-5-one
1967-9201 Screening compound: (4Z)-4-(phenylmethylidene)-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 1967-9201
(4Z)-4-(phenylmethylidene)-2-(3,4,5-trimethoxyphenyl)-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

1967-9201

Molecular Formula

C19H17NO5 (C19 H17 NO5)

Compound Name

(4Z)-4-(phenylmethylidene)-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-4-(phenylmethylidene)-2-(345-trimethoxyphenyl)-45-dihydro-13-oxazol-5-one

SMILES

COc1cc(C(OC2=O)=N/C2=C\c2ccccc2)cc(OC)c1OC

InChI

InChI=1S/C19H17NO5/c1-22-15-10-13(11-16(23-2)17(15)24-3)18-20-14(19(21)25-18)9-12-7-5-4-6-8-12/h4-11H,1-3H3

InChI Key

YWBPSVGCDWIZBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00983961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.35

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

2.934

Distribution Coefficient, logD

2.934

Water Solubility, LogSw

-3.39

Polar Surface Area

53.353

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

1967-9201 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1967-9201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1967-9201?
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What is the minimum amount of 1967-9201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1967-9201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1967-9201
  • 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 1967-9201 available by request