C924-0945 Screening compound: N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-1-yl}acetamide

C924-0945 Screening compound: N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-1-yl}acetamide
C924-0945 Screening compound: N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C924-0945
N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-1-yl}acetamide

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

C924-0945

Molecular Formula

C25H29N3O3 (C25 H29 N3 O3)

Compound Name

N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-1-yl}acetamide

IUPAC name

N-(4-ethoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-14-diazaspiro[4.5]dec-3-en-1-yl}acetamide

SMILES

CCOc(cc1)ccc1NC(CN(C1(CCC(C)CC1)N=C1c2ccccc2)C1=O)=O

InChI

InChI=1S/C25H29N3O3/c1-3-31-21-11-9-20(10-12-21)26-22(29)17-28-24(30)23(19-7-5-4-6-8-19)27-25(28)15-13-18(2)14-16-25/h4-12,18H,3,13-17H2,1-2H3,(H,26,29)

InChI Key

KMUYXZLPAVKGAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14809196

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.597

Distribution Coefficient, logD

4.597

Water Solubility, LogSw

-4.11

Polar Surface Area

54.721

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

C924-0945 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with C924-0945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C924-0945?
Check Price and Availability of C924-0945, 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 C924-0945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C924-0945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C924-0945
  • 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 C924-0945 available by request