G141-0248 Screening compound: methyl 1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

G141-0248 Screening compound: methyl 1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
G141-0248 Screening compound: methyl 1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G141-0248
methyl 1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

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

G141-0248

Molecular Formula

C20H17N3O6 (C20 H17 N3 O6)

Compound Name

methyl 1-{[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

IUPAC name

methyl 1-{[(2H-13-benzodioxol-5-yl)carbamoyl]methyl}-7-methyl-4-oxo-14-dihydro-18-naphthyridine-3-carboxylate

SMILES

Cc(cc1)nc(N(CC(Nc(cc2)cc3c2OCO3)=O)C=C2C(OC)=O)c1C2=O

InChI

InChI=1S/C20H17N3O6/c1-11-3-5-13-18(25)14(20(26)27-2)8-23(19(13)21-11)9-17(24)22-12-4-6-15-16(7-12)29-10-28-15/h3-8H,9-10H2,1-2H3,(H,22,24)

InChI Key

NIMPIYUCTAXJAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.729

Distribution Coefficient, logD

2.729

Water Solubility, LogSw

-3.15

Polar Surface Area

86.706

Acid Dissociation Constant (pKa)

11.49

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G141-0248 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G141-0248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G141-0248?
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What is the minimum amount of G141-0248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G141-0248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G141-0248
  • 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 G141-0248 available by request