8004-2138 Screening compound: 3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)pyrrolidine-2,5-dione

8004-2138 Screening compound: 3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)pyrrolidine-2,5-dione
8004-2138 Screening compound: 3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-2138
3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)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

8004-2138

Molecular Formula

C21H22BrN3O2 (C21 H22 BrN3 O2)

Compound Name

3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)pyrrolidine-2,5-dione

IUPAC name

3-(4-benzylpiperazin-1-yl)-1-(3-bromophenyl)pyrrolidine-25-dione

SMILES

O=C(CC(C1=O)N2CCN(Cc3ccccc3)CC2)N1c1cccc(Br)c1

InChI

InChI=1S/C21H22BrN3O2/c22-17-7-4-8-18(13-17)25-20(26)14-19(21(25)27)24-11-9-23(10-12-24)15-16-5-2-1-3-6-16/h1-8,13,19H,9-12,14-15H2/t19-/m1/s1

InChI Key

USZSDFMFBFKRGA-LJQANCHMSA-N

MDL Number (MFCD)

MFCD00469943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.33

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

2.332

Distribution Coefficient, logD

2.294

Water Solubility, LogSw

-2.84

Polar Surface Area

35.528

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

6.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 8004-2138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-2138?
Check Price and Availability of 8004-2138, 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 8004-2138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-2138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-2138
  • 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 8004-2138 available by request