C519-2264 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide

C519-2264 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
C519-2264 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C519-2264
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide

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

C519-2264

Molecular Formula

C25H27N3O6S (C25 H27 N3 O6 S)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-6-(diethylsulfamoyl)-4-oxo-1-(prop-2-en-1-yl)-14-dihydroquinoline-3-carboxamide

SMILES

CCN(CC)S(c(cc1)cc2c1N(CC=C)C=C(C(NCc(cc1)cc3c1OCO3)=O)C2=O)(=O)=O

InChI

InChI=1S/C25H27N3O6S/c1-4-11-27-15-20(25(30)26-14-17-7-10-22-23(12-17)34-16-33-22)24(29)19-13-18(8-9-21(19)27)35(31,32)28(5-2)6-3/h4,7-10,12-13,15H,1,5-6,11,14,16H2,2-3H3,(H,26,30)

InChI Key

FSGZPRRFHOLJCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765048

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.867

Distribution Coefficient, logD

2.867

Water Solubility, LogSw

-3.68

Polar Surface Area

88.438

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.00

C519-2264 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C519-2264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C519-2264?
Check Price and Availability of C519-2264, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C519-2264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C519-2264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C519-2264
  • 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 C519-2264 available by request