V028-7992 Screening compound: 3-[(4-allylpiperazino)carbonyl]-1-(3-chloro-4-methylphenyl)-2-pyrrolidinone

V028-7992 Screening compound: 3-[(4-allylpiperazino)carbonyl]-1-(3-chloro-4-methylphenyl)-2-pyrrolidinone
V028-7992 Screening compound: 3-[(4-allylpiperazino)carbonyl]-1-(3-chloro-4-methylphenyl)-2-pyrrolidinone alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-7992
3-[(4-allylpiperazino)carbonyl]-1-(3-chloro-4-methylphenyl)-2-pyrrolidinone

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

V028-7992

Molecular Formula

C19H24ClN3O2 (C19 H24 ClN3 O2)

Compound Name

3-[(4-allylpiperazino)carbonyl]-1-(3-chloro-4-methylphenyl)-2-pyrrolidinone

IUPAC name

1-(3-chloro-4-methylphenyl)-3-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]pyrrolidin-2-one

SMILES

Cc(ccc(N(CCC1C(N2CCN(CC=C)CC2)=O)C1=O)c1)c1Cl

InChI

InChI=1S/C19H24ClN3O2/c1-3-7-21-9-11-22(12-10-21)18(24)16-6-8-23(19(16)25)15-5-4-14(2)17(20)13-15/h3-5,13,16H,1,6-12H2,2H3/t16-/m1/s1

InChI Key

UAYXTSJFLGKQQT-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD19921849

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

361.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.597

Distribution Coefficient, logD

0.392

Water Solubility, LogSw

-3.09

Polar Surface Area

37.216

Acid Dissociation Constant (pKa)

5.20

Base Dissociation Constant (pKb)

6.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.37

V028-7992 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V028-7992 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-7992?
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What is the minimum amount of V028-7992 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-7992
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-7992
  • 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 V028-7992 available by request