8018-1255 Screening compound: 7-phenethyl-1-phenyl-1,3,7-triazaspiro[4.5]decan-4-one

8018-1255 Screening compound: 7-phenethyl-1-phenyl-1,3,7-triazaspiro[4.5]decan-4-one
8018-1255 Screening compound: 7-phenethyl-1-phenyl-1,3,7-triazaspiro[4.5]decan-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-1255
7-phenethyl-1-phenyl-1,3,7-triazaspiro[4.5]decan-4-one

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

8018-1255

Molecular Formula

C21H25N3O (C21 H25 N3 O)

Compound Name

7-phenethyl-1-phenyl-1,3,7-triazaspiro[4.5]decan-4-one

IUPAC name

1-phenyl-7-(2-phenylethyl)-137-triazaspiro[4.5]decan-4-one

SMILES

O=C(C12CN(CCc3ccccc3)CCC2)NCN1c1ccccc1

InChI

InChI=1S/C21H25N3O/c25-20-21(24(17-22-20)19-10-5-2-6-11-19)13-7-14-23(16-21)15-12-18-8-3-1-4-9-18/h1-6,8-11H,7,12-17H2,(H,22,25)/t21-/m0/s1

InChI Key

JXDTXVMMITZPOQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD07022764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.180

Distribution Coefficient, logD

3.128

Water Solubility, LogSw

-3.32

Polar Surface Area

30.739

Acid Dissociation Constant (pKa)

14.04

Base Dissociation Constant (pKb)

6.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

8018-1255 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

GPCR Targeted Library (31838 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Anti-HIV1 Library (19540 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
  • Eye
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • GPCR
  • Others
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with 8018-1255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-1255?
Check Price and Availability of 8018-1255, 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 8018-1255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-1255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-1255
  • 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 8018-1255 available by request