8015-6647 Screening compound: 1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)-1-propanone

8015-6647 Screening compound: 1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)-1-propanone
8015-6647 Screening compound: 1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-6647
1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)-1-propanone

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

8015-6647

Molecular Formula

C9H8ClN5O3 (C9 H8 ClN5 O3)

Compound Name

1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)-1-propanone

IUPAC name

1-(4-chloro-1H-pyrazol-1-yl)-2-(4-nitro-1H-pyrazol-1-yl)propan-1-one

SMILES

CC(C(n1ncc(Cl)c1)=O)n1ncc([N+]([O-])=O)c1

InChI

InChI=1S/C9H8ClN5O3/c1-6(9(16)14-4-7(10)2-11-14)13-5-8(3-12-13)15(17)18/h2-6H,1H3/t6-/m0/s1

InChI Key

HFTAOIHZBJCRPD-LURJTMIESA-N

MDL Number (MFCD)

MFCD05257498

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.65

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.492

Distribution Coefficient, logD

0.492

Water Solubility, LogSw

-1.56

Polar Surface Area

75.755

Acid Dissociation Constant (pKa)

14.12

Base Dissociation Constant (pKb)

-2.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.22

8015-6647 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8015-6647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-6647?
Check Price and Availability of 8015-6647, 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 8015-6647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-6647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-6647
  • 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 8015-6647 available by request