J097-0244 Screening compound: 6-ethyl-N~9~-(4-isopropylphenyl)-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide

J097-0244 Screening compound: 6-ethyl-N~9~-(4-isopropylphenyl)-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
J097-0244 Screening compound: 6-ethyl-N~9~-(4-isopropylphenyl)-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J097-0244
6-ethyl-N~9~-(4-isopropylphenyl)-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-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

J097-0244

Molecular Formula

C24H24N2O3S (C24 H24 N2 O3 S)

Compound Name

6-ethyl-N~9~-(4-isopropylphenyl)-5,5-dioxo-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide

IUPAC name

9-ethyl-88-dioxo-N-[4-(propan-2-yl)phenyl]-8lambda6-thia-9-azatricyclo[8.4.0.0^{27}]tetradeca-1(14)2(7)351012-hexaene-13-carboxamide

SMILES

CCN(c(ccc(C(Nc1ccc(C(C)C)cc1)=O)c1)c1-c1c2cccc1)S2(=O)=O

InChI

InChI=1S/C24H24N2O3S/c1-4-26-22-14-11-18(24(27)25-19-12-9-17(10-13-19)16(2)3)15-21(22)20-7-5-6-8-23(20)30(26,28)29/h5-16H,4H2,1-3H3,(H,25,27)

InChI Key

FEYVSDSLQVNMMU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27224970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.331

Distribution Coefficient, logD

5.331

Water Solubility, LogSw

-5.34

Polar Surface Area

53.849

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

-3.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

J097-0244 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with J097-0244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J097-0244?
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What is the minimum amount of J097-0244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J097-0244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J097-0244
  • 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 J097-0244 available by request