G195-0397 Screening compound: 1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,2-dihydropyrazin-2-one

G195-0397 Screening compound: 1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,2-dihydropyrazin-2-one
G195-0397 Screening compound: 1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,2-dihydropyrazin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G195-0397
1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-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

G195-0397

Molecular Formula

C18H12ClF3N2OS (C18 H12 ClF3 N2 OS)

Compound Name

1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-1,2-dihydropyrazin-2-one

IUPAC name

1-(4-chlorophenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-12-dihydropyrazin-2-one

SMILES

O=C(C(SCc1cc(C(F)(F)F)ccc1)=NC=C1)N1c(cc1)ccc1Cl

InChI

InChI=1S/C18H12ClF3N2OS/c19-14-4-6-15(7-5-14)24-9-8-23-16(17(24)25)26-11-12-2-1-3-13(10-12)18(20,21)22/h1-10H,11H2

InChI Key

YVXUJELSCALRCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14984037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.066

Distribution Coefficient, logD

4.066

Water Solubility, LogSw

-4.53

Polar Surface Area

23.643

Acid Dissociation Constant (pKa)

32.72

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with G195-0397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G195-0397?
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What is the minimum amount of G195-0397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G195-0397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G195-0397
  • 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 G195-0397 available by request