1493-0265 Screening compound: 4-[(E)-2-(4-hydroxyphenyl)-1-ethenyl]-2,6-diphenylpyranium

1493-0265 Screening compound: 4-[(E)-2-(4-hydroxyphenyl)-1-ethenyl]-2,6-diphenylpyranium
1493-0265 Screening compound: 4-[(E)-2-(4-hydroxyphenyl)-1-ethenyl]-2,6-diphenylpyranium alternative view

Chemical Structure Depiction of ChemDiv screening compound 1493-0265
4-[(E)-2-(4-hydroxyphenyl)-1-ethenyl]-2,6-diphenylpyranium

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

1493-0265

Molecular Formula

C25H19O2 (C25 H19 O2)

Compound Name

4-[(E)-2-(4-hydroxyphenyl)-1-ethenyl]-2,6-diphenylpyranium

IUPAC name

4-[(1E)-2-(4-hydroxyphenyl)ethenyl]-26-diphenyl-1lambda4-pyran-1-ylium

SMILES

Oc1ccc(/C=C/c2cc(-c3ccccc3)[o+]c(-c3ccccc3)c2)cc1

InChI

InChI=1S/C25H18O2/c26-23-15-13-19(14-16-23)11-12-20-17-24(21-7-3-1-4-8-21)27-25(18-20)22-9-5-2-6-10-22/h1-18H/p+1

InChI Key

KSZOVBJSARSEKS-UHFFFAOYSA-O

MDL Number (MFCD)

MFCD01245829

Chemical and Physical Properties

Saltdata

BF4-

Molecular Weight

351.42

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.937

Distribution Coefficient, logD

5.935

Water Solubility, LogSw

-6.03

Polar Surface Area

23.963

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1493-0265 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 1493-0265 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1493-0265?
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What is the minimum amount of 1493-0265 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1493-0265
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1493-0265
  • 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 1493-0265 available by request