E002-0936 Screening compound: 5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide

E002-0936 Screening compound: 5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide
E002-0936 Screening compound: 5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-0936
5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide

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

E002-0936

Molecular Formula

C21H23N3O2 (C21 H23 N3 O2)

Compound Name

5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide

IUPAC name

5-(5-methyl-1H-indazol-1-yl)-5-oxo-N-(1-phenylethyl)pentanamide

SMILES

CC(c1ccccc1)NC(CCCC(n1ncc2c1ccc(C)c2)=O)=O

InChI

InChI=1S/C21H23N3O2/c1-15-11-12-19-18(13-15)14-22-24(19)21(26)10-6-9-20(25)23-16(2)17-7-4-3-5-8-17/h3-5,7-8,11-14,16H,6,9-10H2,1-2H3,(H,23,25)/t16-/m0/s1

InChI Key

GUKWRBQOGRMGLA-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14834905

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.095

Distribution Coefficient, logD

3.095

Water Solubility, LogSw

-3.24

Polar Surface Area

50.110

Acid Dissociation Constant (pKa)

12.99

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

E002-0936 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Glucocorticoid receptors Library (4806 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Nuclear receptors
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with E002-0936 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-0936?
Check Price and Availability of E002-0936, 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 E002-0936 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-0936
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-0936
  • 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 E002-0936 available by request