S672-0574 Screening compound: 7-ethyl-11-(methylsulfonyl)-3-oxa-7,11-diazaspiro[5.6]dodecane

S672-0574 Screening compound: 7-ethyl-11-(methylsulfonyl)-3-oxa-7,11-diazaspiro[5.6]dodecane
S672-0574 Screening compound: 7-ethyl-11-(methylsulfonyl)-3-oxa-7,11-diazaspiro[5.6]dodecane alternative view

Chemical Structure Depiction of ChemDiv screening compound S672-0574
7-ethyl-11-(methylsulfonyl)-3-oxa-7,11-diazaspiro[5.6]dodecane

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

S672-0574

Molecular Formula

C12H24N2O3S (C12 H24 N2 O3 S)

Compound Name

7-ethyl-11-(methylsulfonyl)-3-oxa-7,11-diazaspiro[5.6]dodecane

IUPAC name

n/a

SMILES

CCN(CCC1)C2(CCOCC2)CN1S(C)(=O)=O

InChI

InChI=1S/C12H24N2O3S/c1-3-13-7-4-8-14(18(2,15)16)11-12(13)5-9-17-10-6-12/h3-11H2,1-2H3

InChI Key

JGYXWGTZEBBVSM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30463227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.777

Distribution Coefficient, logD

0.670

Water Solubility, LogSw

-1.35

Polar Surface Area

42.990

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

6.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

100.00

S672-0574 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 S672-0574 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S672-0574?
Check Price and Availability of S672-0574, 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 S672-0574 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S672-0574
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S672-0574
  • 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 S672-0574 available by request