S509-1249 Screening compound: 3,9-diazaspiro[5.6]dodecan-10-one

S509-1249 Screening compound: 3,9-diazaspiro[5.6]dodecan-10-one
S509-1249 Screening compound: 3,9-diazaspiro[5.6]dodecan-10-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S509-1249
3,9-diazaspiro[5.6]dodecan-10-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

S509-1249

Molecular Formula

C10H18N2O (C10 H18 N2 O)

Compound Name

3,9-diazaspiro[5.6]dodecan-10-one

IUPAC name

39-diazaspiro[5.6]dodecan-10-one

SMILES

O=C1NCCC2(CCNCC2)CC1

InChI

InChI=1S/C10H18N2O/c13-9-1-2-10(5-8-12-9)3-6-11-7-4-10/h11H,1-8H2,(H,12,13)

InChI Key

IOFACBFNQDKXJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18447647

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

182.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

-1.109

Distribution Coefficient, logD

-3.137

Water Solubility, LogSw

0.41

Polar Surface Area

37.666

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

9.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

90.00

S509-1249 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S509-1249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S509-1249?
Check Price and Availability of S509-1249, 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 S509-1249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S509-1249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S509-1249
  • 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 S509-1249 available by request