S914-0037 Screening compound: 7-[2-(3,5-dimethoxyphenyl)acetyl]-1,7-diazaspiro[4.4]nonan-2-one

S914-0037 Screening compound: 7-[2-(3,5-dimethoxyphenyl)acetyl]-1,7-diazaspiro[4.4]nonan-2-one
S914-0037 Screening compound: 7-[2-(3,5-dimethoxyphenyl)acetyl]-1,7-diazaspiro[4.4]nonan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S914-0037
7-[2-(3,5-dimethoxyphenyl)acetyl]-1,7-diazaspiro[4.4]nonan-2-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

S914-0037

Molecular Formula

C17H22N2O4 (C17 H22 N2 O4)

Compound Name

7-[2-(3,5-dimethoxyphenyl)acetyl]-1,7-diazaspiro[4.4]nonan-2-one

IUPAC name

7-[2-(35-dimethoxyphenyl)acetyl]-17-diazaspiro[4.4]nonan-2-one

SMILES

COc1cc(CC(N(CC2)CC2(CC2)NC2=O)=O)cc(OC)c1

InChI

InChI=1S/C17H22N2O4/c1-22-13-7-12(8-14(10-13)23-2)9-16(21)19-6-5-17(11-19)4-3-15(20)18-17/h7-8,10H,3-6,9,11H2,1-2H3,(H,18,20)/t17-/m0/s1

InChI Key

UYYVOAKBVQHFSS-KRWDZBQOSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.226

Distribution Coefficient, logD

1.226

Water Solubility, LogSw

-2.15

Polar Surface Area

57.574

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

-3.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.94

S914-0037 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S914-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S914-0037?
Check Price and Availability of S914-0037, 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 S914-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S914-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S914-0037
  • 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 S914-0037 available by request