G313-0540 Screening compound: 2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(4-fluorophenyl)acetamide

G313-0540 Screening compound: 2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(4-fluorophenyl)acetamide
G313-0540 Screening compound: 2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(4-fluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G313-0540
2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(4-fluorophenyl)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

G313-0540

Molecular Formula

C25H22FN3O4S (C25 H22 FN3 O4 S)

Compound Name

2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridin-1-yl]-N-(4-fluorophenyl)acetamide

IUPAC name

2-[3-(4-ethylbenzenesulfonyl)-7-methyl-4-oxo-14-dihydro-18-naphthyridin-1-yl]-N-(4-fluorophenyl)acetamide

SMILES

CCc(cc1)ccc1S(C1=CN(CC(Nc(cc2)ccc2F)=O)c(nc(C)cc2)c2C1=O)(=O)=O

InChI

InChI=1S/C25H22FN3O4S/c1-3-17-5-11-20(12-6-17)34(32,33)22-14-29(25-21(24(22)31)13-4-16(2)27-25)15-23(30)28-19-9-7-18(26)8-10-19/h4-14H,3,15H2,1-2H3,(H,28,30)

InChI Key

WQTNFAAOVSYTKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.079

Distribution Coefficient, logD

5.079

Water Solubility, LogSw

-4.81

Polar Surface Area

77.918

Acid Dissociation Constant (pKa)

10.91

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with G313-0540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G313-0540?
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What is the minimum amount of G313-0540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G313-0540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G313-0540
  • 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 G313-0540 available by request