G313-0427 Screening compound: 1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-1,4-dihydro-1,8-naphthyridin-4-one

G313-0427 Screening compound: 1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-1,4-dihydro-1,8-naphthyridin-4-one
G313-0427 Screening compound: 1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-1,4-dihydro-1,8-naphthyridin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G313-0427
1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-1,4-dihydro-1,8-naphthyridin-4-one

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

G313-0427

Molecular Formula

C23H18ClFN2O3S (C23 H18 ClFN2 O3 S)

Compound Name

1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-1,4-dihydro-1,8-naphthyridin-4-one

IUPAC name

1-[(2-chloro-6-fluorophenyl)methyl]-7-methyl-3-(4-methylbenzenesulfonyl)-14-dihydro-18-naphthyridin-4-one

SMILES

Cc(cc1)ccc1S(C1=CN(Cc(c(F)ccc2)c2Cl)c2nc(C)ccc2C1=O)(=O)=O

InChI

InChI=1S/C23H18ClFN2O3S/c1-14-6-9-16(10-7-14)31(29,30)21-13-27(12-18-19(24)4-3-5-20(18)25)23-17(22(21)28)11-8-15(2)26-23/h3-11,13H,12H2,1-2H3

InChI Key

LXBGQUVQFFCYPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14997199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.92

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.569

Distribution Coefficient, logD

5.569

Water Solubility, LogSw

-5.82

Polar Surface Area

54.768

Acid Dissociation Constant (pKa)

26.18

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

G313-0427 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G313-0427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G313-0427?
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What is the minimum amount of G313-0427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G313-0427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G313-0427
  • 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 G313-0427 available by request