K261-2811 Screening compound: N~1~-benzyl-2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide

K261-2811 Screening compound: N~1~-benzyl-2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide
K261-2811 Screening compound: N~1~-benzyl-2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-2811
N~1~-benzyl-2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]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

K261-2811

Molecular Formula

C23H21N3O3S2 (C23 H21 N3 O3 S2)

Compound Name

N~1~-benzyl-2-[(4-benzyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide

IUPAC name

N-benzyl-2-[(4-benzyl-11-dioxo-4H-1lambda624-benzothiadiazin-3-yl)sulfanyl]acetamide

SMILES

O=C(CSC(N(Cc1ccccc1)c1c2cccc1)=NS2(=O)=O)NCc1ccccc1

InChI

InChI=1S/C23H21N3O3S2/c27-22(24-15-18-9-3-1-4-10-18)17-30-23-25-31(28,29)21-14-8-7-13-20(21)26(23)16-19-11-5-2-6-12-19/h1-14H,15-17H2,(H,24,27)

InChI Key

DBRBDWSRJNKISA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15085070

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.893

Distribution Coefficient, logD

3.893

Water Solubility, LogSw

-4.06

Polar Surface Area

68.185

Acid Dissociation Constant (pKa)

13.42

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

References: we are preparing a list of scientific research reports with K261-2811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-2811?
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What is the minimum amount of K261-2811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-2811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-2811
  • 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 K261-2811 available by request