K259-0002 Screening compound: 3-(1,3-benzothiazol-2-yl)-6,8-dibromo-2H-chromen-2-one

K259-0002 Screening compound: 3-(1,3-benzothiazol-2-yl)-6,8-dibromo-2H-chromen-2-one
K259-0002 Screening compound: 3-(1,3-benzothiazol-2-yl)-6,8-dibromo-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K259-0002
3-(1,3-benzothiazol-2-yl)-6,8-dibromo-2H-chromen-2-one

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

K259-0002

Molecular Formula

C16H7Br2NO2S (C16 H7 Br2 NO2 S)

Compound Name

3-(1,3-benzothiazol-2-yl)-6,8-dibromo-2H-chromen-2-one

IUPAC name

3-(13-benzothiazol-2-yl)-68-dibromo-2H-chromen-2-one

SMILES

O=C(C(c1nc(cccc2)c2s1)=Cc1cc(Br)c2)Oc1c2Br

InChI

InChI=1S/C16H7Br2NO2S/c17-9-5-8-6-10(16(20)21-14(8)11(18)7-9)15-19-12-3-1-2-4-13(12)22-15/h1-7H

InChI Key

UUWYRKNXQYRCFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06166920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.11

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.626

Distribution Coefficient, logD

5.626

Water Solubility, LogSw

-5.90

Polar Surface Area

30.293

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K259-0002 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with K259-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K259-0002?
Check Price and Availability of K259-0002, 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 K259-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K259-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K259-0002
  • 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 K259-0002 available by request