C791-0427 Screening compound: 2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

C791-0427 Screening compound: 2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
C791-0427 Screening compound: 2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C791-0427
2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-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

C791-0427

Molecular Formula

C19H19N5O3 (C19 H19 N5 O3)

Compound Name

2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

IUPAC name

2-(1H-indazol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

SMILES

[O-][N+](c(cc1)ccc1N(CC1)CCN1C(Cn1ncc2c1cccc2)=O)=O

InChI

InChI=1S/C19H19N5O3/c25-19(14-23-18-4-2-1-3-15(18)13-20-23)22-11-9-21(10-12-22)16-5-7-17(8-6-16)24(26)27/h1-8,13H,9-12,14H2

InChI Key

OUUKHPZNNGVGGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14795738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.429

Distribution Coefficient, logD

2.429

Water Solubility, LogSw

-2.65

Polar Surface Area

66.705

Acid Dissociation Constant (pKa)

24.87

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

C791-0427 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 C791-0427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C791-0427?
Check Price and Availability of C791-0427, 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 C791-0427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C791-0427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C791-0427
  • 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 C791-0427 available by request