K261-1565 Screening compound: 3-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-3-oxopropyl}-6-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

K261-1565 Screening compound: 3-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-3-oxopropyl}-6-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
K261-1565 Screening compound: 3-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-3-oxopropyl}-6-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-1565
3-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-3-oxopropyl}-6-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

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

K261-1565

Molecular Formula

C23H26N4O5S (C23 H26 N4 O5 S)

Compound Name

3-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazino]-3-oxopropyl}-6-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione

IUPAC name

3-(3-{4-[(2H-13-benzodioxol-5-yl)methyl]piperazin-1-yl}-3-oxopropyl)-6-methyl-2H-1lambda624-benzothiadiazine-11-dione

SMILES

Cc(cc1)cc(N=C(CCC(N2CCN(Cc(cc3)cc4c3OCO4)CC2)=O)N2)c1S2(=O)=O

InChI

InChI=1S/C23H26N4O5S/c1-16-2-5-21-18(12-16)24-22(25-33(21,29)30)6-7-23(28)27-10-8-26(9-11-27)14-17-3-4-19-20(13-17)32-15-31-19/h2-5,12-13H,6-11,14-15H2,1H3,(H,24,25)

InChI Key

GCCPLPWGFWVWJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15084481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.494

Distribution Coefficient, logD

0.915

Water Solubility, LogSw

-2.65

Polar Surface Area

87.673

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with K261-1565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-1565?
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What is the minimum amount of K261-1565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-1565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-1565
  • 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 K261-1565 available by request