2738-0248 Screening compound: 1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione

2738-0248 Screening compound: 1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione
2738-0248 Screening compound: 1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2738-0248
1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)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

2738-0248

Molecular Formula

C21H21Cl2N3O2 (C21 H21 Cl2 N3 O2)

Compound Name

1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)piperazin-1-yl]pyrrolidine-2,5-dione

IUPAC name

1-(3-chloro-4-methylphenyl)-3-[4-(4-chlorophenyl)piperazin-1-yl]pyrrolidine-25-dione

SMILES

Cc(ccc(N(C(CC1N(CC2)CCN2c(cc2)ccc2Cl)=O)C1=O)c1)c1Cl

InChI

InChI=1S/C21H21Cl2N3O2/c1-14-2-5-17(12-18(14)23)26-20(27)13-19(21(26)28)25-10-8-24(9-11-25)16-6-3-15(22)4-7-16/h2-7,12,19H,8-11,13H2,1H3/t19-/m1/s1

InChI Key

FTDKFVGTQUXECW-LJQANCHMSA-N

MDL Number (MFCD)

MFCD01907837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.828

Distribution Coefficient, logD

3.828

Water Solubility, LogSw

-4.13

Polar Surface Area

35.248

Acid Dissociation Constant (pKa)

16.60

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

2738-0248 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2738-0248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2738-0248?
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What is the minimum amount of 2738-0248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2738-0248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2738-0248
  • 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 2738-0248 available by request