K261-2093 Screening compound: N~1~-benzyl-N~1~-ethyl-2-[2-(4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide

K261-2093 Screening compound: N~1~-benzyl-N~1~-ethyl-2-[2-(4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide
K261-2093 Screening compound: N~1~-benzyl-N~1~-ethyl-2-[2-(4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-2093
N~1~-benzyl-N~1~-ethyl-2-[2-(4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-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

K261-2093

Molecular Formula

C25H25N3O4S (C25 H25 N3 O4 S)

Compound Name

N~1~-benzyl-N~1~-ethyl-2-[2-(4-methylphenyl)-1,1,3-trioxo-2,3-dihydro-1lambda~6~,2,4-benzothiadiazin-4(1H)-yl]acetamide

IUPAC name

N-benzyl-N-ethyl-2-[2-(4-methylphenyl)-113-trioxo-34-dihydro-2H-1lambda624-benzothiadiazin-4-yl]acetamide

SMILES

CCN(Cc1ccccc1)C(CN(c(cccc1)c1S(N1c2ccc(C)cc2)(=O)=O)C1=O)=O

InChI

InChI=1S/C25H25N3O4S/c1-3-26(17-20-9-5-4-6-10-20)24(29)18-27-22-11-7-8-12-23(22)33(31,32)28(25(27)30)21-15-13-19(2)14-16-21/h4-16H,3,17-18H2,1-2H3

InChI Key

FIJHJKBRUREJEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08140737

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.983

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-3.93

Polar Surface Area

62.423

Acid Dissociation Constant (pKa)

23.12

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with K261-2093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-2093?
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What is the minimum amount of K261-2093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-2093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-2093
  • 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 K261-2093 available by request