V020-5834 Screening compound: 1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(4-methylphenyl)-1-propanone

V020-5834 Screening compound: 1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(4-methylphenyl)-1-propanone
V020-5834 Screening compound: 1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(4-methylphenyl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-5834
1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(4-methylphenyl)-1-propanone

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

V020-5834

Molecular Formula

C27H32N2O3 (C27 H32 N2 O3)

Compound Name

1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-3-(7-ethyl-1H-indol-3-yl)-3-(4-methylphenyl)-1-propanone

IUPAC name

n/a

SMILES

CCc1cccc2c1[nH]cc2C(CC(N(CC1)CCC11OCCO1)=O)c1ccc(C)cc1

InChI

InChI=1S/C27H32N2O3/c1-3-20-5-4-6-22-24(18-28-26(20)22)23(21-9-7-19(2)8-10-21)17-25(30)29-13-11-27(12-14-29)31-15-16-32-27/h4-10,18,23,28H,3,11-17H2,1-2H3/t23-/m1/s1

InChI Key

APWZCONGIMGBCW-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19850935

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.649

Distribution Coefficient, logD

4.649

Water Solubility, LogSw

-4.29

Polar Surface Area

41.166

Acid Dissociation Constant (pKa)

18.17

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

V020-5834 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V020-5834 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-5834?
Check Price and Availability of V020-5834, 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 V020-5834 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-5834
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-5834
  • 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 V020-5834 available by request