K786-2292 Screening compound: N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

K786-2292 Screening compound: N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide
K786-2292 Screening compound: N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-2292
N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-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

K786-2292

Molecular Formula

C23H27N3O5S2 (C23 H27 N3 O5 S2)

Compound Name

N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

IUPAC name

N-[(4-ethylphenyl)methyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]acetamide

SMILES

CCc1ccc(CNC(CN2c(cc(cc3)S(N4CCOCC4)(=O)=O)c3SCC2=O)=O)cc1

InChI

InChI=1S/C23H27N3O5S2/c1-2-17-3-5-18(6-4-17)14-24-22(27)15-26-20-13-19(7-8-21(20)32-16-23(26)28)33(29,30)25-9-11-31-12-10-25/h3-8,13H,2,9-12,14-16H2,1H3,(H,24,27)

InChI Key

TUPMAIISTLIQNN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15100507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.62

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.717

Distribution Coefficient, logD

2.717

Water Solubility, LogSw

-3.24

Polar Surface Area

79.710

Acid Dissociation Constant (pKa)

13.00

Base Dissociation Constant (pKb)

-0.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.13

K786-2292 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K786-2292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-2292?
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What is the minimum amount of K786-2292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-2292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-2292
  • 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 K786-2292 available by request