K786-3411 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetamide

K786-3411 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetamide
K786-3411 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-3411
N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetamide

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

K786-3411

Molecular Formula

C17H14ClFN2O2S (C17 H14 ClFN2 O2 S)

Compound Name

N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-2-(3-oxo-34-dihydro-2H-14-benzothiazin-4-yl)acetamide

SMILES

O=C(CN1c(cccc2)c2SCC1=O)NCc(ccc(F)c1)c1Cl

InChI

InChI=1S/C17H14ClFN2O2S/c18-13-7-12(19)6-5-11(13)8-20-16(22)9-21-14-3-1-2-4-15(14)24-10-17(21)23/h1-7H,8-10H2,(H,20,22)

InChI Key

DJOGGPNZRFXQJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03831687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.382

Distribution Coefficient, logD

3.382

Water Solubility, LogSw

-3.56

Polar Surface Area

40.090

Acid Dissociation Constant (pKa)

12.58

Base Dissociation Constant (pKb)

-2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

K786-3411 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K786-3411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-3411?
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What is the minimum amount of K786-3411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-3411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-3411
  • 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 K786-3411 available by request