Y504-8868 Screening compound: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-propanamine

Y504-8868 Screening compound: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-propanamine
Y504-8868 Screening compound: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-propanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound Y504-8868
3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-propanamine

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

Y504-8868

Molecular Formula

C8H14N4O2 (C8 H14 N4 O2)

Compound Name

3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-propanamine

IUPAC name

3-(35-dimethyl-4-nitro-1H-pyrazol-1-yl)propan-1-amine

SMILES

Cc(n(CCCN)nc1C)c1[N+]([O-])=O

InChI

InChI=1S/C8H14N4O2/c1-6-8(12(13)14)7(2)11(10-6)5-3-4-9/h3-5,9H2,1-2H3

InChI Key

BMJJDBPIECAJGR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

198.22

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.144

Distribution Coefficient, logD

-2.488

Water Solubility, LogSw

-0.08

Polar Surface Area

68.705

Acid Dissociation Constant (pKa)

26.25

Base Dissociation Constant (pKb)

9.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

References: we are preparing a list of scientific research reports with Y504-8868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y504-8868?
Check Price and Availability of Y504-8868, 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 Y504-8868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y504-8868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y504-8868
  • 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 Y504-8868 available by request