K261-1636 Screening compound: N~2~-(4-{[2-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)acetyl]amino}phenyl)-2-furamide

K261-1636 Screening compound: N~2~-(4-{[2-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)acetyl]amino}phenyl)-2-furamide
K261-1636 Screening compound: N~2~-(4-{[2-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)acetyl]amino}phenyl)-2-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K261-1636
N~2~-(4-{[2-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)acetyl]amino}phenyl)-2-furamide

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

K261-1636

Molecular Formula

C20H16N4O5S (C20 H16 N4 O5 S)

Compound Name

N~2~-(4-{[2-(1,1-dioxo-1,2-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)acetyl]amino}phenyl)-2-furamide

IUPAC name

N-{4-[2-(11-dioxo-2H-1lambda624-benzothiadiazin-3-yl)acetamido]phenyl}furan-2-carboxamide

SMILES

O=C(CC(N1)=Nc(cccc2)c2S1(=O)=O)Nc(cc1)ccc1NC(c1ccco1)=O

InChI

InChI=1S/C20H16N4O5S/c25-19(12-18-23-15-4-1-2-6-17(15)30(27,28)24-18)21-13-7-9-14(10-8-13)22-20(26)16-5-3-11-29-16/h1-11H,12H2,(H,21,25)(H,22,26)(H,23,24)

InChI Key

XXLFEFBJVSLUTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15084521

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.311

Distribution Coefficient, logD

1.105

Water Solubility, LogSw

-2.28

Polar Surface Area

105.443

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

K261-1636 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K261-1636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K261-1636?
Check Price and Availability of K261-1636, 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 K261-1636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K261-1636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K261-1636
  • 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 K261-1636 available by request