3204-0256 Screening compound: 1-(3-chloro-4-methylphenyl)-N~3~-(3,4-dimethoxyphenethyl)-5-oxo-3-pyrrolidinecarboxamide

3204-0256 Screening compound: 1-(3-chloro-4-methylphenyl)-N~3~-(3,4-dimethoxyphenethyl)-5-oxo-3-pyrrolidinecarboxamide
3204-0256 Screening compound: 1-(3-chloro-4-methylphenyl)-N~3~-(3,4-dimethoxyphenethyl)-5-oxo-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3204-0256
1-(3-chloro-4-methylphenyl)-N~3~-(3,4-dimethoxyphenethyl)-5-oxo-3-pyrrolidinecarboxamide

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

3204-0256

Molecular Formula

C22H25ClN2O4 (C22 H25 ClN2 O4)

Compound Name

1-(3-chloro-4-methylphenyl)-N~3~-(3,4-dimethoxyphenethyl)-5-oxo-3-pyrrolidinecarboxamide

IUPAC name

1-(3-chloro-4-methylphenyl)-N-[2-(34-dimethoxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

SMILES

Cc(ccc(N(CC(C1)C(NCCc(cc2)cc(OC)c2OC)=O)C1=O)c1)c1Cl

InChI

InChI=1S/C22H25ClN2O4/c1-14-4-6-17(12-18(14)23)25-13-16(11-21(25)26)22(27)24-9-8-15-5-7-19(28-2)20(10-15)29-3/h4-7,10,12,16H,8-9,11,13H2,1-3H3,(H,24,27)/t16-/m1/s1

InChI Key

JTMPCZBZICLAIZ-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD02086682

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.9

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

2.868

Distribution Coefficient, logD

2.868

Water Solubility, LogSw

-3.39

Polar Surface Area

56.504

Acid Dissociation Constant (pKa)

12.88

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.36

3204-0256 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 3204-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3204-0256?
Check Price and Availability of 3204-0256, 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 3204-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3204-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3204-0256
  • 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 3204-0256 available by request