F018-0429 Screening compound: N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide

F018-0429 Screening compound: N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide
F018-0429 Screening compound: N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F018-0429
N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide

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

F018-0429

Molecular Formula

C16H16N6O3 (C16 H16 N6 O3)

Compound Name

N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide

IUPAC name

N-(1-benzyl-1H-pyrazol-3-yl)-3-(3-nitro-1H-pyrazol-1-yl)propanamide

SMILES

[O-][N+](c1nn(CCC(Nc2nn(Cc3ccccc3)cc2)=O)cc1)=O

InChI

InChI=1S/C16H16N6O3/c23-16(8-11-20-10-7-15(19-20)22(24)25)17-14-6-9-21(18-14)12-13-4-2-1-3-5-13/h1-7,9-10H,8,11-12H2,(H,17,18,23)

InChI Key

FXCYOAOLUJYPKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04048149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.075

Distribution Coefficient, logD

1.073

Water Solubility, LogSw

-2.23

Polar Surface Area

85.556

Acid Dissociation Constant (pKa)

9.72

Base Dissociation Constant (pKb)

0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with F018-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F018-0429?
Check Price and Availability of F018-0429, 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 F018-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F018-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F018-0429
  • 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 F018-0429 available by request