K017-0031 Screening compound: 2-{2-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid

K017-0031 Screening compound: 2-{2-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid
K017-0031 Screening compound: 2-{2-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K017-0031
2-{2-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid

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

K017-0031

Molecular Formula

C15H10N4O5 (C15 H10 N4 O5)

Compound Name

2-{2-[(3E)-5-nitro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid

IUPAC name

2-{2-[(3E)-5-nitro-2-oxo-23-dihydro-1H-indol-3-ylidene]hydrazin-1-yl}benzoic acid

SMILES

[O-][N+](c(cc1)cc(/C2=N\Nc(cccc3)c3C(O)=O)c1NC2=O)=O

InChI

InChI=1S/C15H10N4O5/c20-14-13(10-7-8(19(23)24)5-6-11(10)16-14)18-17-12-4-2-1-3-9(12)15(21)22/h1-7,17H,(H,21,22)(H,16,18,20)

InChI Key

WTZBMHASLNVXQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.27

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.560

Distribution Coefficient, logD

0.018

Water Solubility, LogSw

-3.80

Polar Surface Area

106.277

Acid Dissociation Constant (pKa)

3.86

Base Dissociation Constant (pKb)

0.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K017-0031 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with K017-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K017-0031?
Check Price and Availability of K017-0031, 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 K017-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K017-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K017-0031
  • 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 K017-0031 available by request