Y504-8811 Screening compound: 3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-propanol

Y504-8811 Screening compound: 3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-propanol
Y504-8811 Screening compound: 3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y504-8811
3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-propanol

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

Y504-8811

Molecular Formula

C7H11N3O3 (C7 H11 N3 O3)

Compound Name

3-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-propanol

IUPAC name

n/a

SMILES

Cc1cc([N+]([O-])=O)nn1CCCO

InChI

InChI=1S/C7H11N3O3/c1-6-5-7(10(12)13)8-9(6)3-2-4-11/h5,11H,2-4H2,1H3

InChI Key

XIOXNZFOKSQAEF-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

185.18

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.140

Distribution Coefficient, logD

-0.140

Water Solubility, LogSw

-0.81

Polar Surface Area

63.918

Acid Dissociation Constant (pKa)

15.98

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with Y504-8811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y504-8811?
Check Price and Availability of Y504-8811, 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 Y504-8811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y504-8811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y504-8811
  • 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 Y504-8811 available by request