G894-0878 Screening compound: 1-[(2,3-dimethoxyphenyl)methyl]-2-methyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide

G894-0878 Screening compound: 1-[(2,3-dimethoxyphenyl)methyl]-2-methyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
G894-0878 Screening compound: 1-[(2,3-dimethoxyphenyl)methyl]-2-methyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G894-0878
1-[(2,3-dimethoxyphenyl)methyl]-2-methyl-N-[(4-methylphenyl)methyl]-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

G894-0878

Molecular Formula

C23H28N2O4 (C23 H28 N2 O4)

Compound Name

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

IUPAC name

1-[(23-dimethoxyphenyl)methyl]-2-methyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide

SMILES

CC(CC1)(C(NCc2ccc(C)cc2)=O)N(Cc(cccc2OC)c2OC)C1=O

InChI

InChI=1S/C23H28N2O4/c1-16-8-10-17(11-9-16)14-24-22(27)23(2)13-12-20(26)25(23)15-18-6-5-7-19(28-3)21(18)29-4/h5-11H,12-15H2,1-4H3,(H,24,27)/t23-/m0/s1

InChI Key

MMKROQXCUAJNCA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD15073901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.324

Distribution Coefficient, logD

3.324

Water Solubility, LogSw

-3.44

Polar Surface Area

56.609

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

G894-0878 in Drug Discovery

Included in Screening Libraries

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)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G894-0878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G894-0878?
Check Price and Availability of G894-0878, 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 G894-0878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G894-0878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G894-0878
  • 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 G894-0878 available by request