Y021-0305 Screening compound: 4-(3,5-DIMETHYL-1H-PYRAZOLE-1-CARBONYL)PYRIDINE

Y021-0305 Screening compound: 4-(3,5-DIMETHYL-1H-PYRAZOLE-1-CARBONYL)PYRIDINE
Y021-0305 Screening compound: 4-(3,5-DIMETHYL-1H-PYRAZOLE-1-CARBONYL)PYRIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0305
4-(3,5-DIMETHYL-1H-PYRAZOLE-1-CARBONYL)PYRIDINE

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

Y021-0305

Molecular Formula

C11H11N3O (C11 H11 N3 O)

Compound Name

4-(3,5-DIMETHYL-1H-PYRAZOLE-1-CARBONYL)PYRIDINE

IUPAC name

4-(35-dimethyl-1H-pyrazole-1-carbonyl)pyridine

SMILES

Cc1cc(C)nn1C(c1ccncc1)=O

InChI

InChI=1S/C11H11N3O/c1-8-7-9(2)14(13-8)11(15)10-3-5-12-6-4-10/h3-7H,1-2H3

InChI Key

VXESXFNPRURVHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00455536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

201.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.349

Distribution Coefficient, logD

0.349

Water Solubility, LogSw

-0.70

Polar Surface Area

36.734

Acid Dissociation Constant (pKa)

27.51

Base Dissociation Constant (pKb)

3.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

Y021-0305 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with Y021-0305 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0305?
Check Price and Availability of Y021-0305, 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 Y021-0305 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0305
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0305
  • 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 Y021-0305 available by request