3448-4190 Screening compound: 1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-2,5-dione

3448-4190 Screening compound: 1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-2,5-dione
3448-4190 Screening compound: 1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3448-4190
1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-2,5-dione

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

3448-4190

Molecular Formula

C21H21Cl2N3O2 (C21 H21 Cl2 N3 O2)

Compound Name

1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-2,5-dione

IUPAC name

1-(3-chlorophenyl)-3-{4-[(4-chlorophenyl)methyl]piperazin-1-yl}pyrrolidine-25-dione

SMILES

O=C(CC(C1=O)N2CCN(Cc(cc3)ccc3Cl)CC2)N1c1cccc(Cl)c1

InChI

InChI=1S/C21H21Cl2N3O2/c22-16-6-4-15(5-7-16)14-24-8-10-25(11-9-24)19-13-20(27)26(21(19)28)18-3-1-2-17(23)12-18/h1-7,12,19H,8-11,13-14H2/t19-/m1/s1

InChI Key

WQNOPHPESMNOSW-LJQANCHMSA-N

MDL Number (MFCD)

MFCD02642645

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.772

Distribution Coefficient, logD

2.761

Water Solubility, LogSw

-3.24

Polar Surface Area

35.528

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

5.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

3448-4190 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3448-4190 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3448-4190?
Check Price and Availability of 3448-4190, 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 3448-4190 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3448-4190
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3448-4190
  • 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 3448-4190 available by request