J097-0200 Screening compound: 9-[3,4-dihydro-2(1H)-isoquinolinylcarbonyl]-6-ethyl-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

J097-0200 Screening compound: 9-[3,4-dihydro-2(1H)-isoquinolinylcarbonyl]-6-ethyl-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione
J097-0200 Screening compound: 9-[3,4-dihydro-2(1H)-isoquinolinylcarbonyl]-6-ethyl-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound J097-0200
9-[3,4-dihydro-2(1H)-isoquinolinylcarbonyl]-6-ethyl-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

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

J097-0200

Molecular Formula

C24H22N2O3S (C24 H22 N2 O3 S)

Compound Name

9-[3,4-dihydro-2(1H)-isoquinolinylcarbonyl]-6-ethyl-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione

IUPAC name

n/a

SMILES

CCN(c(ccc(C(N(CC1)Cc2c1cccc2)=O)c1)c1-c1c2cccc1)S2(=O)=O

InChI

InChI=1S/C24H22N2O3S/c1-2-26-22-12-11-18(15-21(22)20-9-5-6-10-23(20)30(26,28)29)24(27)25-14-13-17-7-3-4-8-19(17)16-25/h3-12,15H,2,13-14,16H2,1H3

InChI Key

ASURMUHMDGKCII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27224948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.859

Distribution Coefficient, logD

3.859

Water Solubility, LogSw

-3.87

Polar Surface Area

47.068

Acid Dissociation Constant (pKa)

25.26

Base Dissociation Constant (pKb)

-5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

J097-0200 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with J097-0200 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J097-0200?
Check Price and Availability of J097-0200, 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 J097-0200 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J097-0200
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J097-0200
  • 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 J097-0200 available by request