K786-5957 Screening compound: N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide

K786-5957 Screening compound: N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl]acetamide
K786-5957 Screening compound: N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-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 K786-5957
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-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

K786-5957

Molecular Formula

C23H34N4O5S2 (C23 H34 N4 O5 S2)

Compound Name

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

IUPAC name

N-[2-(26-dimethylpiperidin-1-yl)ethyl]-2-[6-(morpholine-4-sulfonyl)-3-oxo-34-dihydro-2H-14-benzothiazin-4-yl]acetamide

SMILES

CC1N(CCNC(CN2c(cc(cc3)S(N4CCOCC4)(=O)=O)c3SCC2=O)=O)C(C)CCC1

InChI

InChI=1S/C23H34N4O5S2/c1-17-4-3-5-18(2)26(17)9-8-24-22(28)15-27-20-14-19(6-7-21(20)33-16-23(27)29)34(30,31)25-10-12-32-13-11-25/h6-7,14,17-18H,3-5,8-13,15-16H2,1-2H3,(H,24,28)

InChI Key

LBISQKJPTYNEDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05033046

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.68

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.371

Distribution Coefficient, logD

-0.635

Water Solubility, LogSw

-2.56

Polar Surface Area

82.089

Acid Dissociation Constant (pKa)

13.79

Base Dissociation Constant (pKb)

9.40

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

65.20

References: we are preparing a list of scientific research reports with K786-5957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-5957?
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What is the minimum amount of K786-5957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-5957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-5957
  • 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 K786-5957 available by request