Y032-2867 Screening compound: ethyl 1-[(E)-3-(4-nitrophenyl)-2-propenoyl]-3-piperidinecarboxylate

Y032-2867 Screening compound: ethyl 1-[(E)-3-(4-nitrophenyl)-2-propenoyl]-3-piperidinecarboxylate
Y032-2867 Screening compound: ethyl 1-[(E)-3-(4-nitrophenyl)-2-propenoyl]-3-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-2867
ethyl 1-[(E)-3-(4-nitrophenyl)-2-propenoyl]-3-piperidinecarboxylate

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

Y032-2867

Molecular Formula

C17H20N2O5 (C17 H20 N2 O5)

Compound Name

ethyl 1-[(E)-3-(4-nitrophenyl)-2-propenoyl]-3-piperidinecarboxylate

IUPAC name

ethyl 1-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(/C=C/c(cc1)ccc1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C17H20N2O5/c1-2-24-17(21)14-4-3-11-18(12-14)16(20)10-7-13-5-8-15(9-6-13)19(22)23/h5-10,14H,2-4,11-12H2,1H3/t14-/m0/s1

InChI Key

JCKBOVJENNCERS-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD03638210

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.36

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.653

Distribution Coefficient, logD

2.653

Water Solubility, LogSw

-2.72

Polar Surface Area

70.428

Acid Dissociation Constant (pKa)

22.59

Base Dissociation Constant (pKb)

2.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

Y032-2867 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y032-2867 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-2867?
Check Price and Availability of Y032-2867, 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 Y032-2867 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-2867
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-2867
  • 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 Y032-2867 available by request