G835-0065F Screening compound: 2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide

G835-0065F Screening compound: 2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
G835-0065F Screening compound: 2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G835-0065F
2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]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

G835-0065F

Molecular Formula

C17H16F3N3O2 (C17 H16 F3 N3 O2)

Compound Name

2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide

IUPAC name

2-(3-oxo-235678-hexahydrocinnolin-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide

SMILES

O=C(CN1N=C(CCCC2)C2=CC1=O)Nc1c(C(F)(F)F)cccc1

InChI

InChI=1S/C17H16F3N3O2/c18-17(19,20)12-6-2-4-8-14(12)21-15(24)10-23-16(25)9-11-5-1-3-7-13(11)22-23/h2,4,6,8-9H,1,3,5,7,10H2,(H,21,24)

InChI Key

WTYDMTGRAFFMRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15039529

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.647

Distribution Coefficient, logD

2.647

Water Solubility, LogSw

-3.35

Polar Surface Area

50.684

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.29

G835-0065F in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G835-0065F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G835-0065F?
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What is the minimum amount of G835-0065F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G835-0065F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G835-0065F
  • 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 G835-0065F available by request