G894-0314 Screening compound: 1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

G894-0314 Screening compound: 1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
G894-0314 Screening compound: 1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G894-0314
1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-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

G894-0314

Molecular Formula

C17H23ClN2O3 (C17 H23 ClN2 O3)

Compound Name

1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

IUPAC name

1-(4-chloro-2-methylphenyl)-N-(3-methoxypropyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

SMILES

CC(CCC1=O)(C(NCCCOC)=O)N1c(cc1)c(C)cc1Cl

InChI

InChI=1S/C17H23ClN2O3/c1-12-11-13(18)5-6-14(12)20-15(21)7-8-17(20,2)16(22)19-9-4-10-23-3/h5-6,11H,4,7-10H2,1-3H3,(H,19,22)/t17-/m0/s1

InChI Key

GROTYLOBSRPFKN-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD15073816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.643

Distribution Coefficient, logD

2.643

Water Solubility, LogSw

-3.48

Polar Surface Area

48.805

Acid Dissociation Constant (pKa)

12.77

Base Dissociation Constant (pKb)

-0.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.90

G894-0314 in Drug Discovery

Included in Screening Libraries

Cyclic Ugi PPI Library (9586 compounds)

Protein-Protein Interaction Library (218420 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

References: we are preparing a list of scientific research reports with G894-0314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G894-0314?
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What is the minimum amount of G894-0314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G894-0314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G894-0314
  • 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 G894-0314 available by request