C141-0096 Screening compound: 4-(1,4-DIOXA-8-AZASPIRO[4.5]DEC-8-YLCARBONYL)-1,5-BIS(4-METHOXYPHENYL)-2-PYRROLIDINONE

C141-0096 Screening compound: 4-(1,4-DIOXA-8-AZASPIRO[4.5]DEC-8-YLCARBONYL)-1,5-BIS(4-METHOXYPHENYL)-2-PYRROLIDINONE
C141-0096 Screening compound: 4-(1,4-DIOXA-8-AZASPIRO[4.5]DEC-8-YLCARBONYL)-1,5-BIS(4-METHOXYPHENYL)-2-PYRROLIDINONE alternative view

Chemical Structure Depiction of ChemDiv screening compound C141-0096
4-(1,4-DIOXA-8-AZASPIRO[4.5]DEC-8-YLCARBONYL)-1,5-BIS(4-METHOXYPHENYL)-2-PYRROLIDINONE

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

C141-0096

Molecular Formula

C26H30N2O6 (C26 H30 N2 O6)

Compound Name

4-(1,4-DIOXA-8-AZASPIRO[4.5]DEC-8-YLCARBONYL)-1,5-BIS(4-METHOXYPHENYL)-2-PYRROLIDINONE

IUPAC name

n/a

SMILES

COc1ccc(C(C(CC2=O)C(N(CC3)CCC33OCCO3)=O)N2c(cc2)ccc2OC)cc1

InChI

InChI=1S/C26H30N2O6/c1-31-20-7-3-18(4-8-20)24-22(17-23(29)28(24)19-5-9-21(32-2)10-6-19)25(30)27-13-11-26(12-14-27)33-15-16-34-26/h3-10,22,24H,11-17H2,1-2H3

InChI Key

MTMVBBGLRLDOEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14722250

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.330

Distribution Coefficient, logD

2.330

Water Solubility, LogSw

-2.93

Polar Surface Area

62.128

Acid Dissociation Constant (pKa)

11.29

Base Dissociation Constant (pKb)

-1.83

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

16.00

C141-0096 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 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
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with C141-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C141-0096?
Check Price and Availability of C141-0096, 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 C141-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C141-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C141-0096
  • 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 C141-0096 available by request