S663-0072 Screening compound: N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide

S663-0072 Screening compound: N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide
S663-0072 Screening compound: N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S663-0072
N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide

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

S663-0072

Molecular Formula

C18H30N2O3 (C18 H30 N2 O3)

Compound Name

N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide

IUPAC name

N-[7-(2-cyclopentylacetyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide

SMILES

COCC(NC(CC1)C1(CC1)CCN1C(CC1CCCC1)=O)=O

InChI

InChI=1S/C18H30N2O3/c1-23-13-16(21)19-15-6-7-18(15)8-10-20(11-9-18)17(22)12-14-4-2-3-5-14/h14-15H,2-13H2,1H3,(H,19,21)/t15-/m0/s1

InChI Key

WITYPDSQECOLFP-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD30463504

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.226

Distribution Coefficient, logD

1.226

Water Solubility, LogSw

-1.55

Polar Surface Area

49.988

Acid Dissociation Constant (pKa)

15.47

Base Dissociation Constant (pKb)

1.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

88.89

S663-0072 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 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

Structure:
  • 3D
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S663-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S663-0072?
Check Price and Availability of S663-0072, 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 S663-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S663-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S663-0072
  • 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 S663-0072 available by request