8009-2495 Screening compound: 3-allyl-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one

8009-2495 Screening compound: 3-allyl-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
8009-2495 Screening compound: 3-allyl-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-2495
3-allyl-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-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

8009-2495

Molecular Formula

C12H19NO3 (C12 H19 NO3)

Compound Name

3-allyl-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one

IUPAC name

4-hydroxy-4-methyl-3-(prop-2-en-1-yl)-1-oxa-3-azaspiro[4.5]decan-2-one

SMILES

CC(C1(CCCCC1)O1)(N(CC=C)C1=O)O

InChI

InChI=1S/C12H19NO3/c1-3-9-13-10(14)16-12(11(13,2)15)7-5-4-6-8-12/h3,15H,1,4-9H2,2H3/t11-/m0/s1

InChI Key

VUAQCTSYBWSECD-NSHDSACASA-N

MDL Number (MFCD)

MFCD01572605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

225.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.115

Distribution Coefficient, logD

2.115

Water Solubility, LogSw

-1.89

Polar Surface Area

39.379

Acid Dissociation Constant (pKa)

15.67

Base Dissociation Constant (pKb)

-4.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

75.00

8009-2495 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
  • Agro
Structure:
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8009-2495 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-2495?
Check Price and Availability of 8009-2495, 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 8009-2495 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-2495
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-2495
  • 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 8009-2495 available by request