K026-0268 Screening compound: 3-(6-nitro-1H-1,3-benzodiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

K026-0268 Screening compound: 3-(6-nitro-1H-1,3-benzodiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one
K026-0268 Screening compound: 3-(6-nitro-1H-1,3-benzodiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K026-0268
3-(6-nitro-1H-1,3-benzodiazol-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

K026-0268

Molecular Formula

C19H13N3O4 (C19 H13 N3 O4)

Compound Name

3-(6-nitro-1H-1,3-benzodiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

IUPAC name

3-(6-nitro-1H-13-benzodiazol-2-yl)-8-(prop-2-en-1-yl)-2H-chromen-2-one

SMILES

C=CCc1cccc(C=C2c3nc(ccc([N+]([O-])=O)c4)c4[nH]3)c1OC2=O

InChI

InChI=1S/C19H13N3O4/c1-2-4-11-5-3-6-12-9-14(19(23)26-17(11)12)18-20-15-8-7-13(22(24)25)10-16(15)21-18/h2-3,5-10H,1,4H2,(H,20,21)

InChI Key

KRVZCVLLAGRAMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.239

Distribution Coefficient, logD

4.238

Water Solubility, LogSw

-4.65

Polar Surface Area

73.245

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

-2.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

K026-0268 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K026-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K026-0268?
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What is the minimum amount of K026-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K026-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K026-0268
  • 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 K026-0268 available by request