K259-0014 Screening compound: 3-(1,3-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

K259-0014 Screening compound: 3-(1,3-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one
K259-0014 Screening compound: 3-(1,3-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K259-0014
3-(1,3-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-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

K259-0014

Molecular Formula

C19H13NO2S (C19 H13 NO2 S)

Compound Name

3-(1,3-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

IUPAC name

3-(13-benzothiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

SMILES

C=CCc1cccc(C=C2c3nc(cccc4)c4s3)c1OC2=O

InChI

InChI=1S/C19H13NO2S/c1-2-6-12-7-5-8-13-11-14(19(21)22-17(12)13)18-20-15-9-3-4-10-16(15)23-18/h2-5,7-11H,1,6H2

InChI Key

UPGLKGYQUFFWKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15084137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.009

Distribution Coefficient, logD

5.009

Water Solubility, LogSw

-5.03

Polar Surface Area

30.293

Acid Dissociation Constant (pKa)

26.19

Base Dissociation Constant (pKb)

-4.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

K259-0014 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K259-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K259-0014?
Check Price and Availability of K259-0014, 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 K259-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K259-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K259-0014
  • 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 K259-0014 available by request