K783-6244 Screening compound: 4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzoic acid

K783-6244 Screening compound: 4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzoic acid
K783-6244 Screening compound: 4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-6244
4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzoic acid

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

K783-6244

Molecular Formula

C24H19NO3S (C24 H19 NO3 S)

Compound Name

4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene]methyl}benzoic acid

IUPAC name

4-{[(2Z)-4-[(3-methylphenyl)methyl]-3-oxo-34-dihydro-2H-14-benzothiazin-2-ylidene]methyl}benzoic acid

SMILES

Cc1cccc(CN(c(cccc2)c2S/C2=C\c(cc3)ccc3C(O)=O)C2=O)c1

InChI

InChI=1S/C24H19NO3S/c1-16-5-4-6-18(13-16)15-25-20-7-2-3-8-21(20)29-22(23(25)26)14-17-9-11-19(12-10-17)24(27)28/h2-14H,15H2,1H3,(H,27,28)

InChI Key

QGAGLKJFBMNVSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15096364

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.140

Distribution Coefficient, logD

2.533

Water Solubility, LogSw

-5.36

Polar Surface Area

43.478

Acid Dissociation Constant (pKa)

3.79

Base Dissociation Constant (pKb)

-5.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

K783-6244 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K783-6244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-6244?
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What is the minimum amount of K783-6244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-6244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-6244
  • 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 K783-6244 available by request