K261-2538 Screening compound: 2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-cyclohexylacetamide

K261-2538 Screening compound: 2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-cyclohexylacetamide
K261-2538 Screening compound: 2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-2538
2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]-N~1~-cyclohexylacetamide

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

K261-2538

Molecular Formula

C19H27N3O3S2 (C19 H27 N3 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCCCN(c1c2cccc1)C(SCC(NC1CCCCC1)=O)=NS2(=O)=O

InChI

InChI=1S/C19H27N3O3S2/c1-2-3-13-22-16-11-7-8-12-17(16)27(24,25)21-19(22)26-14-18(23)20-15-9-5-4-6-10-15/h7-8,11-12,15H,2-6,9-10,13-14H2,1H3,(H,20,23)

InChI Key

NBIQAFUXSJADLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15084962

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.57

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

3.770

Distribution Coefficient, logD

3.770

Water Solubility, LogSw

-3.72

Polar Surface Area

68.160

Acid Dissociation Constant (pKa)

15.89

Base Dissociation Constant (pKb)

6.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

References: we are preparing a list of scientific research reports with K261-2538 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-2538?
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What is the minimum amount of K261-2538 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-2538
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-2538
  • 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 K261-2538 available by request