K783-5358 Screening compound: methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate

K783-5358 Screening compound: methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate
K783-5358 Screening compound: methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K783-5358
methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate

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

K783-5358

Molecular Formula

C18H14BrNO3S (C18 H14 BrNO3 S)

Compound Name

methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetate

IUPAC name

methyl 2-[(2Z)-2-[(3-bromophenyl)methylidene]-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]acetate

SMILES

COC(CN(c(cccc1)c1S/C1=C\c2cccc(Br)c2)C1=O)=O

InChI

InChI=1S/C18H14BrNO3S/c1-23-17(21)11-20-14-7-2-3-8-15(14)24-16(18(20)22)10-12-5-4-6-13(19)9-12/h2-10H,11H2,1H3

InChI Key

UTKVSROXKOAAPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15096127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.28

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.324

Distribution Coefficient, logD

4.324

Water Solubility, LogSw

-4.36

Polar Surface Area

35.920

Acid Dissociation Constant (pKa)

21.44

Base Dissociation Constant (pKb)

-6.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with K783-5358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K783-5358?
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What is the minimum amount of K783-5358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K783-5358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K783-5358
  • 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 K783-5358 available by request