K261-0969 Screening compound: 4-(2-chlorobenzyl)-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

K261-0969 Screening compound: 4-(2-chlorobenzyl)-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
K261-0969 Screening compound: 4-(2-chlorobenzyl)-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-0969
4-(2-chlorobenzyl)-2-phenyl-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

K261-0969

Molecular Formula

C20H15ClN2O3S (C20 H15 ClN2 O3 S)

Compound Name

4-(2-chlorobenzyl)-2-phenyl-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione

IUPAC name

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

SMILES

O=C(N(Cc(cccc1)c1Cl)c1c2cccc1)N(c1ccccc1)S2(=O)=O

InChI

InChI=1S/C20H15ClN2O3S/c21-17-11-5-4-8-15(17)14-22-18-12-6-7-13-19(18)27(25,26)23(20(22)24)16-9-2-1-3-10-16/h1-13H,14H2

InChI Key

GIHKVRXVMZPNDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15084301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.617

Distribution Coefficient, logD

4.617

Water Solubility, LogSw

-4.66

Polar Surface Area

46.743

Acid Dissociation Constant (pKa)

28.24

Base Dissociation Constant (pKb)

-11.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with K261-0969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-0969?
Check Price and Availability of K261-0969, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K261-0969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-0969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-0969
  • 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 K261-0969 available by request