S567-0220 Screening compound: 2-cyclopentyl-1-{9-[(dimethylamino)methyl]-9-hydroxy-3-azaspiro[5.5]undec-3-yl}-1-ethanone

S567-0220 Screening compound: 2-cyclopentyl-1-{9-[(dimethylamino)methyl]-9-hydroxy-3-azaspiro[5.5]undec-3-yl}-1-ethanone
S567-0220 Screening compound: 2-cyclopentyl-1-{9-[(dimethylamino)methyl]-9-hydroxy-3-azaspiro[5.5]undec-3-yl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound S567-0220
2-cyclopentyl-1-{9-[(dimethylamino)methyl]-9-hydroxy-3-azaspiro[5.5]undec-3-yl}-1-ethanone

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

S567-0220

Molecular Formula

C20H36N2O2 (C20 H36 N2 O2)

Compound Name

2-cyclopentyl-1-{9-[(dimethylamino)methyl]-9-hydroxy-3-azaspiro[5.5]undec-3-yl}-1-ethanone

IUPAC name

n/a

SMILES

CN(C)CC(CC1)(CCC1(CC1)CCN1C(CC1CCCC1)=O)O

InChI

InChI=1S/C20H36N2O2/c1-21(2)16-20(24)9-7-19(8-10-20)11-13-22(14-12-19)18(23)15-17-5-3-4-6-17/h17,24H,3-16H2,1-2H3

InChI Key

XBKXAVZBVGMFQD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29014836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.794

Distribution Coefficient, logD

0.556

Water Solubility, LogSw

-1.74

Polar Surface Area

36.298

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

8.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

95.00

S567-0220 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S567-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S567-0220?
Check Price and Availability of S567-0220, 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 S567-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S567-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S567-0220
  • 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 S567-0220 available by request