K783-6314 Screening compound: methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate

K783-6314 Screening compound: methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate
K783-6314 Screening compound: methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-6314
methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate

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

K783-6314

Molecular Formula

C20H19NO5S (C20 H19 NO5 S)

Compound Name

methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate

IUPAC name

methyl (2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-3-oxo-34-dihydro-2H-14-benzothiazine-6-carboxylate

SMILES

CCOc(ccc(/C=C1/Sc(ccc(C(OC)=O)c2)c2NC1=O)c1)c1OC

InChI

InChI=1S/C20H19NO5S/c1-4-26-15-7-5-12(9-16(15)24-2)10-18-19(22)21-14-11-13(20(23)25-3)6-8-17(14)27-18/h5-11H,4H2,1-3H3,(H,21,22)

InChI Key

MSOSTOKBYRXHTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15096374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.994

Distribution Coefficient, logD

3.994

Water Solubility, LogSw

-4.24

Polar Surface Area

60.859

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

-5.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with K783-6314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-6314?
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What is the minimum amount of K783-6314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-6314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-6314
  • 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 K783-6314 available by request