S663-0178 Screening compound: N-[7-(cyclohexylmethyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide

S663-0178 Screening compound: N-[7-(cyclohexylmethyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide
S663-0178 Screening compound: N-[7-(cyclohexylmethyl)-7-azaspiro[3.5]nonan-1-yl]-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S663-0178
N-[7-(cyclohexylmethyl)-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

S663-0178

Molecular Formula

C18H32N2O2 (C18 H32 N2 O2)

Compound Name

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

IUPAC name

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

SMILES

COCC(NC(CC1)C11CCN(CC2CCCCC2)CC1)=O

InChI

InChI=1S/C18H32N2O2/c1-22-14-17(21)19-16-7-8-18(16)9-11-20(12-10-18)13-15-5-3-2-4-6-15/h15-16H,2-14H2,1H3,(H,19,21)/t16-/m0/s1

InChI Key

WMCXJGPUEWLCID-INIZCTEOSA-N

MDL Number (MFCD)

MFCD31982937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.453

Distribution Coefficient, logD

0.252

Water Solubility, LogSw

-2.39

Polar Surface Area

37.233

Acid Dissociation Constant (pKa)

15.47

Base Dissociation Constant (pKb)

9.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

94.44

S663-0178 in Drug Discovery

Included in Screening Libraries

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

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 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
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with S663-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S663-0178?
Check Price and Availability of S663-0178, 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 S663-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S663-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S663-0178
  • 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 S663-0178 available by request