8013-6367 Screening compound: 1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate

8013-6367 Screening compound: 1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate
8013-6367 Screening compound: 1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-6367
1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate

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

8013-6367

Molecular Formula

C13H14N2O2 (C13 H14 N2 O2)

Compound Name

1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate

IUPAC name

1-phenyl-2-(1H-pyrazol-1-yl)ethyl acetate

SMILES

CC(OC(Cn1nccc1)c1ccccc1)=O

InChI

InChI=1S/C13H14N2O2/c1-11(16)17-13(10-15-9-5-8-14-15)12-6-3-2-4-7-12/h2-9,13H,10H2,1H3/t13-/m0/s1

InChI Key

FZBBPYRIYMDYDM-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD03767198

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

230.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.567

Distribution Coefficient, logD

1.567

Water Solubility, LogSw

-1.55

Polar Surface Area

35.165

Acid Dissociation Constant (pKa)

24.24

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

8013-6367 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
  • Agro
Targets:
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8013-6367 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-6367?
Check Price and Availability of 8013-6367, 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 8013-6367 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-6367
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-6367
  • 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 8013-6367 available by request