Y031-8378 Screening compound: ethyl 4-(2-thienylcarbonyl)tetrahydro-1(2H)-pyrazinecarboxylate

Y031-8378 Screening compound: ethyl 4-(2-thienylcarbonyl)tetrahydro-1(2H)-pyrazinecarboxylate
Y031-8378 Screening compound: ethyl 4-(2-thienylcarbonyl)tetrahydro-1(2H)-pyrazinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-8378
ethyl 4-(2-thienylcarbonyl)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

Y031-8378

Molecular Formula

C12H16N2O3S (C12 H16 N2 O3 S)

Compound Name

ethyl 4-(2-thienylcarbonyl)tetrahydro-1(2H)-pyrazinecarboxylate

IUPAC name

ethyl 4-(thiophene-2-carbonyl)piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c1cccs1)=O)=O

InChI

InChI=1S/C12H16N2O3S/c1-2-17-12(16)14-7-5-13(6-8-14)11(15)10-4-3-9-18-10/h3-4,9H,2,5-8H2,1H3

InChI Key

ARSWMQVJDOVPTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00784243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.776

Distribution Coefficient, logD

1.776

Water Solubility, LogSw

-2.27

Polar Surface Area

40.685

Acid Dissociation Constant (pKa)

29.94

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

Y031-8378 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with Y031-8378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-8378?
Check Price and Availability of Y031-8378, 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 Y031-8378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-8378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-8378
  • 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 Y031-8378 available by request