S451-0325 Screening compound: N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide

S451-0325 Screening compound: N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide
S451-0325 Screening compound: N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S451-0325
N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide

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

S451-0325

Molecular Formula

C16H16N4O2 (C16 H16 N4 O2)

Compound Name

N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide

IUPAC name

N-(4-ethoxyphenyl)-3-(1H-pyrrol-2-yl)-1H-pyrazole-5-carboxamide

SMILES

CCOc(cc1)ccc1NC(c1cc(-c2ccc[nH]2)n[nH]1)=O

InChI

InChI=1S/C16H16N4O2/c1-2-22-12-7-5-11(6-8-12)18-16(21)15-10-14(19-20-15)13-4-3-9-17-13/h3-10,17H,2H2,1H3,(H,18,21)(H,19,20)

InChI Key

UENYYSAHEOMPAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29004492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.219

Distribution Coefficient, logD

3.219

Water Solubility, LogSw

-3.45

Polar Surface Area

63.009

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

S451-0325 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with S451-0325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S451-0325?
Check Price and Availability of S451-0325, 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 S451-0325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S451-0325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S451-0325
  • 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 S451-0325 available by request