K261-1383 Screening compound: 2-(3-chlorophenyl)-4-(3-methoxybenzyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

K261-1383 Screening compound: 2-(3-chlorophenyl)-4-(3-methoxybenzyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
K261-1383 Screening compound: 2-(3-chlorophenyl)-4-(3-methoxybenzyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-1383
2-(3-chlorophenyl)-4-(3-methoxybenzyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

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

K261-1383

Molecular Formula

C21H17ClN2O4S (C21 H17 ClN2 O4 S)

Compound Name

2-(3-chlorophenyl)-4-(3-methoxybenzyl)-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

IUPAC name

2-(3-chlorophenyl)-4-[(3-methoxyphenyl)methyl]-34-dihydro-2H-1lambda624-benzothiadiazine-113-trione

SMILES

COc1cccc(CN(c(cccc2)c2S(N2c3cccc(Cl)c3)(=O)=O)C2=O)c1

InChI

InChI=1S/C21H17ClN2O4S/c1-28-18-9-4-6-15(12-18)14-23-19-10-2-3-11-20(19)29(26,27)24(21(23)25)17-8-5-7-16(22)13-17/h2-13H,14H2,1H3

InChI Key

FCIFQRAZCNIIED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06751227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.9

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.928

Distribution Coefficient, logD

4.928

Water Solubility, LogSw

-4.82

Polar Surface Area

54.286

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

-9.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

References: we are preparing a list of scientific research reports with K261-1383 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-1383?
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What is the minimum amount of K261-1383 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-1383
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-1383
  • 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 K261-1383 available by request