0546-0103 Screening compound: 3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine

0546-0103 Screening compound: 3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine
0546-0103 Screening compound: 3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0546-0103
3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine

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

0546-0103

Molecular Formula

C7H10N4O2 (C7 H10 N4 O2)

Compound Name

3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine

IUPAC name

3-methyl-4-nitro-N-(prop-2-en-1-yl)-1H-pyrazol-5-amine

SMILES

Cc1n[nH]c(NCC=C)c1[N+]([O-])=O

InChI

InChI=1S/C7H10N4O2/c1-3-4-8-7-6(11(12)13)5(2)9-10-7/h3H,1,4H2,2H3,(H2,8,9,10)

InChI Key

GGMCNUOABIKFRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00462135

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

182.18

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.737

Distribution Coefficient, logD

0.737

Water Solubility, LogSw

-1.32

Polar Surface Area

67.344

Acid Dissociation Constant (pKa)

7.40

Base Dissociation Constant (pKb)

-3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 0546-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0546-0103?
Check Price and Availability of 0546-0103, 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 0546-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0546-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0546-0103
  • 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 0546-0103 available by request