C255-0257 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide

C255-0257 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
C255-0257 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C255-0257
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide

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

C255-0257

Molecular Formula

C21H32N2O4 (C21 H32 N2 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-methyl-1-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide

SMILES

CC(C)CCN(C(C)(CC1)C(NCCc(cc2)cc(OC)c2OC)=O)C1=O

InChI

InChI=1S/C21H32N2O4/c1-15(2)10-13-23-19(24)8-11-21(23,3)20(25)22-12-9-16-6-7-17(26-4)18(14-16)27-5/h6-7,14-15H,8-13H2,1-5H3,(H,22,25)/t21-/m0/s1

InChI Key

NUBKPVPLXLIUHW-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14736200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.456

Distribution Coefficient, logD

2.456

Water Solubility, LogSw

-2.81

Polar Surface Area

56.614

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

C255-0257 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 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 C255-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C255-0257?
Check Price and Availability of C255-0257, 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 C255-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C255-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C255-0257
  • 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 C255-0257 available by request