Y032-3405 Screening compound: ethyl 4-[2-(2-thienyl)acetyl]tetrahydro-1(2H)-pyrazinecarboxylate

Y032-3405 Screening compound: ethyl 4-[2-(2-thienyl)acetyl]tetrahydro-1(2H)-pyrazinecarboxylate
Y032-3405 Screening compound: ethyl 4-[2-(2-thienyl)acetyl]tetrahydro-1(2H)-pyrazinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-3405
ethyl 4-[2-(2-thienyl)acetyl]tetrahydro-1(2H)-pyrazinecarboxylate

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

Y032-3405

Molecular Formula

C13H18N2O3S (C13 H18 N2 O3 S)

Compound Name

ethyl 4-[2-(2-thienyl)acetyl]tetrahydro-1(2H)-pyrazinecarboxylate

IUPAC name

ethyl 4-[2-(thiophen-2-yl)acetyl]piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(Cc1cccs1)=O)=O

InChI

InChI=1S/C13H18N2O3S/c1-2-18-13(17)15-7-5-14(6-8-15)12(16)10-11-4-3-9-19-11/h3-4,9H,2,5-8,10H2,1H3

InChI Key

CRHOAJUSHPAKBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03710027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.470

Distribution Coefficient, logD

1.470

Water Solubility, LogSw

-2.15

Polar Surface Area

40.158

Acid Dissociation Constant (pKa)

22.63

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.85

Y032-3405 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y032-3405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-3405?
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What is the minimum amount of Y032-3405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-3405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-3405
  • 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 Y032-3405 available by request