Y032-1057 Screening compound: (E)-3-(2-chlorophenyl)-1-(2-ethylpiperidino)-2-propen-1-one

Y032-1057 Screening compound: (E)-3-(2-chlorophenyl)-1-(2-ethylpiperidino)-2-propen-1-one
Y032-1057 Screening compound: (E)-3-(2-chlorophenyl)-1-(2-ethylpiperidino)-2-propen-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-1057
(E)-3-(2-chlorophenyl)-1-(2-ethylpiperidino)-2-propen-1-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

Y032-1057

Molecular Formula

C16H20ClNO (C16 H20 ClNO)

Compound Name

(E)-3-(2-chlorophenyl)-1-(2-ethylpiperidino)-2-propen-1-one

IUPAC name

(2E)-3-(2-chlorophenyl)-1-(2-ethylpiperidin-1-yl)prop-2-en-1-one

SMILES

CCC(CCCC1)N1C(/C=C/c(cccc1)c1Cl)=O

InChI

InChI=1S/C16H20ClNO/c1-2-14-8-5-6-12-18(14)16(19)11-10-13-7-3-4-9-15(13)17/h3-4,7,9-11,14H,2,5-6,8,12H2,1H3/t14-/m0/s1

InChI Key

UMBNLDGZSRMLOD-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD00705472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.79

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.033

Distribution Coefficient, logD

4.033

Water Solubility, LogSw

-4.20

Polar Surface Area

16.006

Acid Dissociation Constant (pKa)

26.62

Base Dissociation Constant (pKb)

3.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.75

Y032-1057 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y032-1057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-1057?
Check Price and Availability of Y032-1057, 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 Y032-1057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-1057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-1057
  • 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 Y032-1057 available by request