G835-0014 Screening compound: N-(4-methylphenyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide

G835-0014 Screening compound: N-(4-methylphenyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide
G835-0014 Screening compound: N-(4-methylphenyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G835-0014
N-(4-methylphenyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)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

G835-0014

Molecular Formula

C17H19N3O2 (C17 H19 N3 O2)

Compound Name

N-(4-methylphenyl)-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide

IUPAC name

N-(4-methylphenyl)-2-(3-oxo-235678-hexahydrocinnolin-2-yl)acetamide

SMILES

Cc(cc1)ccc1NC(CN1N=C(CCCC2)C2=CC1=O)=O

InChI

InChI=1S/C17H19N3O2/c1-12-6-8-14(9-7-12)18-16(21)11-20-17(22)10-13-4-2-3-5-15(13)19-20/h6-10H,2-5,11H2,1H3,(H,18,21)

InChI Key

XRAYDSBDCQTAGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10565361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.555

Distribution Coefficient, logD

2.555

Water Solubility, LogSw

-2.88

Polar Surface Area

51.382

Acid Dissociation Constant (pKa)

12.96

Base Dissociation Constant (pKb)

1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

G835-0014 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G835-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G835-0014?
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What is the minimum amount of G835-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G835-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G835-0014
  • 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 G835-0014 available by request