K017-0045 Screening compound: 5-amino-N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide

K017-0045 Screening compound: 5-amino-N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide
K017-0045 Screening compound: 5-amino-N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K017-0045
5-amino-N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide

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

K017-0045

Molecular Formula

C13H9BrN6O3 (C13 H9 BrN6 O3)

Compound Name

5-amino-N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide

IUPAC name

5-amino-N'-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-6-oxo-16-dihydropyridazine-3-carbohydrazide

SMILES

NC1=CC(C(N/N=C(\c(cc(cc2)Br)c2N2)/C2=O)=O)=NNC1=O

InChI

InChI=1S/C13H9BrN6O3/c14-5-1-2-8-6(3-5)10(13(23)16-8)18-20-12(22)9-4-7(15)11(21)19-17-9/h1-4H,(H2,15,17)(H,19,21)(H,20,22)(H,16,18,23)

InChI Key

USDGDHUQEWAWHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.16

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.000

Distribution Coefficient, logD

-1.143

Water Solubility, LogSw

-2.40

Polar Surface Area

116.645

Acid Dissociation Constant (pKa)

5.17

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with K017-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K017-0045?
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What is the minimum amount of K017-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K017-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K017-0045
  • 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 K017-0045 available by request