8018-8593 Screening compound: 1-phenyl-1H-pyrazole-4-carboxylic acid

8018-8593 Screening compound: 1-phenyl-1H-pyrazole-4-carboxylic acid
8018-8593 Screening compound: 1-phenyl-1H-pyrazole-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8593
1-phenyl-1H-pyrazole-4-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

8018-8593

Molecular Formula

C10H8N2O2 (C10 H8 N2 O2)

Compound Name

1-phenyl-1H-pyrazole-4-carboxylic acid

IUPAC name

1-phenyl-1H-pyrazole-4-carboxylic acid

SMILES

OC(c1cn(-c2ccccc2)nc1)=O

InChI

InChI=1S/C10H8N2O2/c13-10(14)8-6-11-12(7-8)9-4-2-1-3-5-9/h1-7H,(H,13,14)

InChI Key

ZROILLPDIUNLSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00514518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

188.19

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.758

Distribution Coefficient, logD

-3.181

Water Solubility, LogSw

-1.80

Polar Surface Area

43.004

Acid Dissociation Constant (pKa)

2.46

Base Dissociation Constant (pKb)

-1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8018-8593 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 8018-8593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8593?
Check Price and Availability of 8018-8593, 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 8018-8593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8593
  • 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 8018-8593 available by request