Y032-1337 Screening compound: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-2-propenamide

Y032-1337 Screening compound: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-2-propenamide
Y032-1337 Screening compound: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-2-propenamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-1337
(E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-2-propenamide

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

Y032-1337

Molecular Formula

C17H12N2O3 (C17 H12 N2 O3)

Compound Name

(E)-3-(1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-2-propenamide

IUPAC name

(2E)-3-(2H-13-benzodioxol-5-yl)-N-(4-cyanophenyl)prop-2-enamide

SMILES

N#Cc(cc1)ccc1NC(/C=C/c(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C17H12N2O3/c18-10-13-1-5-14(6-2-13)19-17(20)8-4-12-3-7-15-16(9-12)22-11-21-15/h1-9H,11H2,(H,19,20)

InChI Key

RTWWROJJJMPJJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02603806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.357

Distribution Coefficient, logD

3.356

Water Solubility, LogSw

-3.63

Polar Surface Area

57.288

Acid Dissociation Constant (pKa)

10.43

Base Dissociation Constant (pKb)

-1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.88

Y032-1337 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Kinases
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y032-1337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-1337?
Check Price and Availability of Y032-1337, 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 Y032-1337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-1337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-1337
  • 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 Y032-1337 available by request