G194-0048 Screening compound: 1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-1,2-dihydropyrazin-2-one

G194-0048 Screening compound: 1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-1,2-dihydropyrazin-2-one
G194-0048 Screening compound: 1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-1,2-dihydropyrazin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G194-0048
1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-1,2-dihydropyrazin-2-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

G194-0048

Molecular Formula

C16H15N3OS (C16 H15 N3 OS)

Compound Name

1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-1,2-dihydropyrazin-2-one

IUPAC name

1-(3-methylphenyl)-3-{[(thiophen-2-yl)methyl]amino}-12-dihydropyrazin-2-one

SMILES

Cc1cccc(N(C=CN=C2NCc3cccs3)C2=O)c1

InChI

InChI=1S/C16H15N3OS/c1-12-4-2-5-13(10-12)19-8-7-17-15(16(19)20)18-11-14-6-3-9-21-14/h2-10H,11H2,1H3,(H,17,18)

InChI Key

CUBJEOWRCHHRST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.151

Distribution Coefficient, logD

2.151

Water Solubility, LogSw

-2.62

Polar Surface Area

36.320

Acid Dissociation Constant (pKa)

11.26

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

G194-0048 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with G194-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G194-0048?
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What is the minimum amount of G194-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G194-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G194-0048
  • 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 G194-0048 available by request