G313-0041 Screening compound: 2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide

G313-0041 Screening compound: 2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide
G313-0041 Screening compound: 2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G313-0041
2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(2H-1,3-benzodioxol-5-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

G313-0041

Molecular Formula

C24H19N3O6S (C24 H19 N3 O6 S)

Compound Name

2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(2H-1,3-benzodioxol-5-yl)acetamide

IUPAC name

2-[3-(benzenesulfonyl)-7-methyl-4-oxo-14-dihydro-18-naphthyridin-1-yl]-N-(2H-13-benzodioxol-5-yl)acetamide

SMILES

Cc(cc1)nc(N(CC(Nc(cc2)cc3c2OCO3)=O)C=C2S(c3ccccc3)(=O)=O)c1C2=O

InChI

InChI=1S/C24H19N3O6S/c1-15-7-9-18-23(29)21(34(30,31)17-5-3-2-4-6-17)12-27(24(18)25-15)13-22(28)26-16-8-10-19-20(11-16)33-14-32-19/h2-12H,13-14H2,1H3,(H,26,28)

InChI Key

IKFWGHMCZCEPPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.768

Distribution Coefficient, logD

3.768

Water Solubility, LogSw

-3.90

Polar Surface Area

95.033

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

G313-0041 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G313-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G313-0041?
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What is the minimum amount of G313-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G313-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G313-0041
  • 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 G313-0041 available by request