K261-3040 Screening compound: 2-[(4-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-phenylacetamide

K261-3040 Screening compound: 2-[(4-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-phenylacetamide
K261-3040 Screening compound: 2-[(4-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-3040
2-[(4-ethyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-phenylacetamide

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

K261-3040

Molecular Formula

C17H17N3O3S2 (C17 H17 N3 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCN(c1c2cccc1)C(SCC(Nc1ccccc1)=O)=NS2(=O)=O

InChI

InChI=1S/C17H17N3O3S2/c1-2-20-14-10-6-7-11-15(14)25(22,23)19-17(20)24-12-16(21)18-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,18,21)

InChI Key

RRBYQGIDIPFGRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15085242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.718

Distribution Coefficient, logD

2.718

Water Solubility, LogSw

-3.30

Polar Surface Area

66.859

Acid Dissociation Constant (pKa)

12.93

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with K261-3040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-3040?
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What is the minimum amount of K261-3040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-3040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-3040
  • 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 K261-3040 available by request