1488-0953 Screening compound: (2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide

1488-0953 Screening compound: (2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide
1488-0953 Screening compound: (2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-0953
(2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide

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

1488-0953

Molecular Formula

C18H16N2O2 (C18 H16 N2 O2)

Compound Name

(2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide

IUPAC name

(2E)-2-cyano-N-(3-ethoxyphenyl)-3-phenylprop-2-enamide

SMILES

CCOc1cccc(NC(/C(/C#N)=C/c2ccccc2)=O)c1

InChI

InChI=1S/C18H16N2O2/c1-2-22-17-10-6-9-16(12-17)20-18(21)15(13-19)11-14-7-4-3-5-8-14/h3-12H,2H2,1H3,(H,20,21)

InChI Key

ITLBNFDPIHSJOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532478

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.006

Distribution Coefficient, logD

3.994

Water Solubility, LogSw

-4.07

Polar Surface Area

47.509

Acid Dissociation Constant (pKa)

8.96

Base Dissociation Constant (pKb)

-3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1488-0953 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

KRAS-Targeted Library (16000 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 1488-0953 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-0953?
Check Price and Availability of 1488-0953, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 1488-0953 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-0953
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-0953
  • 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 1488-0953 available by request