G195-0013 Screening compound: N-benzyl-2-[(3-oxo-4-phenyl-3,4-dihydropyrazin-2-yl)sulfanyl]acetamide

G195-0013 Screening compound: N-benzyl-2-[(3-oxo-4-phenyl-3,4-dihydropyrazin-2-yl)sulfanyl]acetamide
G195-0013 Screening compound: N-benzyl-2-[(3-oxo-4-phenyl-3,4-dihydropyrazin-2-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G195-0013
N-benzyl-2-[(3-oxo-4-phenyl-3,4-dihydropyrazin-2-yl)sulfanyl]acetamide

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

G195-0013

Molecular Formula

C19H17N3O2S (C19 H17 N3 O2 S)

Compound Name

N-benzyl-2-[(3-oxo-4-phenyl-3,4-dihydropyrazin-2-yl)sulfanyl]acetamide

IUPAC name

N-benzyl-2-[(3-oxo-4-phenyl-34-dihydropyrazin-2-yl)sulfanyl]acetamide

SMILES

O=C(CSC1=NC=CN(c2ccccc2)C1=O)NCc1ccccc1

InChI

InChI=1S/C19H17N3O2S/c23-17(21-13-15-7-3-1-4-8-15)14-25-18-19(24)22(12-11-20-18)16-9-5-2-6-10-16/h1-12H,13-14H2,(H,21,23)

InChI Key

YFTBMNGIRLFMHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14983851

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.672

Distribution Coefficient, logD

1.672

Water Solubility, LogSw

-2.11

Polar Surface Area

48.114

Acid Dissociation Constant (pKa)

13.44

Base Dissociation Constant (pKb)

0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

G195-0013 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G195-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G195-0013?
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What is the minimum amount of G195-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G195-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G195-0013
  • 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 G195-0013 available by request