6049-1092 Screening compound: 3-[3,4-DIHYDRO-1(2H)-QUINOLINYLCARBONYL]-1H-ISOCHROMEN-1-ONE

6049-1092 Screening compound: 3-[3,4-DIHYDRO-1(2H)-QUINOLINYLCARBONYL]-1H-ISOCHROMEN-1-ONE
6049-1092 Screening compound: 3-[3,4-DIHYDRO-1(2H)-QUINOLINYLCARBONYL]-1H-ISOCHROMEN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1092
3-[3,4-DIHYDRO-1(2H)-QUINOLINYLCARBONYL]-1H-ISOCHROMEN-1-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

6049-1092

Molecular Formula

C19H15NO3 (C19 H15 NO3)

Compound Name

3-[3,4-DIHYDRO-1(2H)-QUINOLINYLCARBONYL]-1H-ISOCHROMEN-1-ONE

IUPAC name

n/a

SMILES

O=C(C(O1)=Cc(cccc2)c2C1=O)N(CCC1)c2c1cccc2

InChI

InChI=1S/C19H15NO3/c21-18(20-11-5-8-13-6-2-4-10-16(13)20)17-12-14-7-1-3-9-15(14)19(22)23-17/h1-4,6-7,9-10,12H,5,8,11H2

InChI Key

VGFZYPWFYITNPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01417348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.549

Distribution Coefficient, logD

3.549

Water Solubility, LogSw

-3.75

Polar Surface Area

37.958

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

6049-1092 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

Dark Chemical Matter Library (18430 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 6049-1092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1092?
Check Price and Availability of 6049-1092, 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 6049-1092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1092
  • 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 6049-1092 available by request