E002-0665 Screening compound: 2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide

E002-0665 Screening compound: 2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide
E002-0665 Screening compound: 2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-0665
2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide

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

E002-0665

Molecular Formula

C18H18ClN3O (C18 H18 ClN3 O)

Compound Name

2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide

IUPAC name

2-(4-chloro-1H-indazol-1-yl)-N-(2-phenylpropyl)acetamide

SMILES

CC(CNC(Cn(c1ccc2)ncc1c2Cl)=O)c1ccccc1

InChI

InChI=1S/C18H18ClN3O/c1-13(14-6-3-2-4-7-14)10-20-18(23)12-22-17-9-5-8-16(19)15(17)11-21-22/h2-9,11,13H,10,12H2,1H3,(H,20,23)/t13-/m0/s1

InChI Key

XETIGANEFNORLC-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14834712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.81

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.993

Distribution Coefficient, logD

3.993

Water Solubility, LogSw

-4.21

Polar Surface Area

38.142

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

E002-0665 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Nuclear receptors

References: we are preparing a list of scientific research reports with E002-0665 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-0665?
Check Price and Availability of E002-0665, 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 E002-0665 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-0665
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-0665
  • 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 E002-0665 available by request