R052-2029 Screening compound: 3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid

R052-2029 Screening compound: 3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid
R052-2029 Screening compound: 3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R052-2029
3-(propan-2-yl)-1H-pyrazole-5-carboxylic 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

R052-2029

Molecular Formula

C7H10N2O2 (C7 H10 N2 O2)

Compound Name

3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid

IUPAC name

3-(propan-2-yl)-1H-pyrazole-5-carboxylic acid

SMILES

CC(C)c1n[nH]c(C(O)=O)c1

InChI

InChI=1S/C7H10N2O2/c1-4(2)5-3-6(7(10)11)9-8-5/h3-4H,1-2H3,(H,8,9)(H,10,11)

InChI Key

CHWXKAHFWLSLOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02224142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

154.17

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.169

Distribution Coefficient, logD

-2.283

Water Solubility, LogSw

-1.66

Polar Surface Area

51.408

Acid Dissociation Constant (pKa)

3.95

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

R052-2029 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with R052-2029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R052-2029?
Check Price and Availability of R052-2029, 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 R052-2029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R052-2029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R052-2029
  • 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 R052-2029 available by request