C301-1940 Screening compound: 1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one

C301-1940 Screening compound: 1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one
C301-1940 Screening compound: 1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-1940
1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one

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

C301-1940

Molecular Formula

C22H24N4O4 (C22 H24 N4 O4)

Compound Name

1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one

IUPAC name

1-{2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}-4-phenylpyrrolidin-2-one

SMILES

[O-][N+](c(cc1)ccc1N(CC1)CCN1C(CN(CC(C1)c2ccccc2)C1=O)=O)=O

InChI

InChI=1S/C22H24N4O4/c27-21-14-18(17-4-2-1-3-5-17)15-25(21)16-22(28)24-12-10-23(11-13-24)19-6-8-20(9-7-19)26(29)30/h1-9,18H,10-16H2/t18-/m1/s1

InChI Key

PDKUPMJWSUFJOF-GOSISDBHSA-N

MDL Number (MFCD)

MFCD14742371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.396

Distribution Coefficient, logD

2.396

Water Solubility, LogSw

-2.71

Polar Surface Area

70.197

Acid Dissociation Constant (pKa)

13.11

Base Dissociation Constant (pKb)

0.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

C301-1940 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 C301-1940 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-1940?
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What is the minimum amount of C301-1940 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-1940
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-1940
  • 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 C301-1940 available by request