G646-0530 Screening compound: 2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-1,4-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

G646-0530 Screening compound: 2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-1,4-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
G646-0530 Screening compound: 2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-1,4-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G646-0530
2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-1,4-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]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

G646-0530

Molecular Formula

C25H21N3O4S (C25 H21 N3 O4 S)

Compound Name

2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-1,4-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

IUPAC name

2-[7-methoxy-4-oxo-3-(pyridine-4-carbonyl)-14-dihydroquinolin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide

SMILES

COc(cc1)cc(N(CC(Nc2cccc(SC)c2)=O)C=C2C(c3ccncc3)=O)c1C2=O

InChI

InChI=1S/C25H21N3O4S/c1-32-18-6-7-20-22(13-18)28(15-23(29)27-17-4-3-5-19(12-17)33-2)14-21(25(20)31)24(30)16-8-10-26-11-9-16/h3-14H,15H2,1-2H3,(H,27,29)

InChI Key

SQWTUTDDAGAEQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.540

Distribution Coefficient, logD

3.540

Water Solubility, LogSw

-3.92

Polar Surface Area

69.151

Acid Dissociation Constant (pKa)

12.53

Base Dissociation Constant (pKb)

0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

G646-0530 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G646-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G646-0530?
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What is the minimum amount of G646-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G646-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G646-0530
  • 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 G646-0530 available by request