G141-0099 Screening compound: ethyl 1-({[(2-chlorophenyl)methyl]carbamoyl}methyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

G141-0099 Screening compound: ethyl 1-({[(2-chlorophenyl)methyl]carbamoyl}methyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
G141-0099 Screening compound: ethyl 1-({[(2-chlorophenyl)methyl]carbamoyl}methyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G141-0099
ethyl 1-({[(2-chlorophenyl)methyl]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

G141-0099

Molecular Formula

C21H20ClN3O4 (C21 H20 ClN3 O4)

Compound Name

ethyl 1-({[(2-chlorophenyl)methyl]carbamoyl}methyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate

IUPAC name

ethyl 1-({[(2-chlorophenyl)methyl]carbamoyl}methyl)-7-methyl-4-oxo-14-dihydro-18-naphthyridine-3-carboxylate

SMILES

CCOC(C1=CN(CC(NCc(cccc2)c2Cl)=O)c2nc(C)ccc2C1=O)=O

InChI

InChI=1S/C21H20ClN3O4/c1-3-29-21(28)16-11-25(20-15(19(16)27)9-8-13(2)24-20)12-18(26)23-10-14-6-4-5-7-17(14)22/h4-9,11H,3,10,12H2,1-2H3,(H,23,26)

InChI Key

IZMGRRWIUBBWER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14982828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.86

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.644

Distribution Coefficient, logD

3.644

Water Solubility, LogSw

-3.96

Polar Surface Area

70.493

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

-2.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G141-0099 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 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

References: we are preparing a list of scientific research reports with G141-0099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G141-0099?
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What is the minimum amount of G141-0099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G141-0099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G141-0099
  • 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 G141-0099 available by request