D012-0071 Screening compound: 3-(5-methyl-1H-pyrazol-1-yl)propanoic acid

D012-0071 Screening compound: 3-(5-methyl-1H-pyrazol-1-yl)propanoic acid
D012-0071 Screening compound: 3-(5-methyl-1H-pyrazol-1-yl)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D012-0071
3-(5-methyl-1H-pyrazol-1-yl)propanoic acid

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

D012-0071

Molecular Formula

C7H10N2O2 (C7 H10 N2 O2)

Compound Name

3-(5-methyl-1H-pyrazol-1-yl)propanoic acid

IUPAC name

3-(5-methyl-1H-pyrazol-1-yl)propanoic acid

SMILES

Cc1ccnn1CCC(O)=O

InChI

InChI=1S/C7H10N2O2/c1-6-2-4-8-9(6)5-3-7(10)11/h2,4H,3,5H2,1H3,(H,10,11)

InChI Key

AVWPEIKOPXXROD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00996156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

154.17

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

-0.770

Distribution Coefficient, logD

-3.590

Water Solubility, LogSw

-1.10

Polar Surface Area

42.935

Acid Dissociation Constant (pKa)

4.58

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

D012-0071 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D012-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D012-0071?
Check Price and Availability of D012-0071, 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 D012-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D012-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D012-0071
  • 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 D012-0071 available by request