K786-5969 Screening compound: N-[3-(2-ethylpiperidin-1-yl)propyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

K786-5969 Screening compound: N-[3-(2-ethylpiperidin-1-yl)propyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide
K786-5969 Screening compound: N-[3-(2-ethylpiperidin-1-yl)propyl]-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 K786-5969
N-[3-(2-ethylpiperidin-1-yl)propyl]-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

K786-5969

Molecular Formula

C24H36N4O5S2 (C24 H36 N4 O5 S2)

Compound Name

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

IUPAC name

N-[3-(2-ethylpiperidin-1-yl)propyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]acetamide

SMILES

CCC1N(CCCNC(CN2c(cc(cc3)S(N4CCOCC4)(=O)=O)c3SCC2=O)=O)CCCC1

InChI

InChI=1S/C24H36N4O5S2/c1-2-19-6-3-4-10-26(19)11-5-9-25-23(29)17-28-21-16-20(7-8-22(21)34-18-24(28)30)35(31,32)27-12-14-33-15-13-27/h7-8,16,19H,2-6,9-15,17-18H2,1H3,(H,25,29)/t19-/m0/s1

InChI Key

AKHMVYPHFWCPES-IBGZPJMESA-N

MDL Number (MFCD)

MFCD05033049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.71

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.645

Distribution Coefficient, logD

-1.280

Water Solubility, LogSw

-2.67

Polar Surface Area

83.346

Acid Dissociation Constant (pKa)

15.51

Base Dissociation Constant (pKb)

10.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

K786-5969 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

MCL1 Targeted Library (12200 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with K786-5969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-5969?
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What is the minimum amount of K786-5969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-5969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-5969
  • 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 K786-5969 available by request