J096-0043 Screening compound: N-[4-carbamoyl-2-(methylamino)-1,3-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-carboxamide

J096-0043 Screening compound: N-[4-carbamoyl-2-(methylamino)-1,3-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-carboxamide
J096-0043 Screening compound: N-[4-carbamoyl-2-(methylamino)-1,3-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J096-0043
N-[4-carbamoyl-2-(methylamino)-1,3-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-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

J096-0043

Molecular Formula

C19H15N5O3S (C19 H15 N5 O3 S)

Compound Name

N-[4-carbamoyl-2-(methylamino)-1,3-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-carboxamide

IUPAC name

N-[4-carbamoyl-2-(methylamino)-13-thiazol-5-yl]-2-(furan-2-yl)quinoline-4-carboxamide

SMILES

CNc1nc(C(N)=O)c(NC(c2cc(-c3ccco3)nc3ccccc23)=O)s1

InChI

InChI=1S/C19H15N5O3S/c1-21-19-23-15(16(20)25)18(28-19)24-17(26)11-9-13(14-7-4-8-27-14)22-12-6-3-2-5-10(11)12/h2-9H,1H3,(H2,20,25)(H,21,23)(H,24,26)

InChI Key

FKYOQJJAAKPWCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12130006

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.532

Distribution Coefficient, logD

2.530

Water Solubility, LogSw

-3.22

Polar Surface Area

94.275

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

J096-0043 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with J096-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J096-0043?
Check Price and Availability of J096-0043, 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 J096-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J096-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J096-0043
  • 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 J096-0043 available by request