L058-0596 Screening compound: 1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinoxaline-2,3-dione

L058-0596 Screening compound: 1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinoxaline-2,3-dione
L058-0596 Screening compound: 1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinoxaline-2,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L058-0596
1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinoxaline-2,3-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

L058-0596

Molecular Formula

C24H25ClN4O3 (C24 H25 ClN4 O3)

Compound Name

1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinoxaline-2,3-dione

IUPAC name

1-{3-[4-(4-chlorophenyl)piperazin-1-yl]-3-oxopropyl}-4-(prop-2-en-1-yl)-1234-tetrahydroquinoxaline-23-dione

SMILES

C=CCN(c(cccc1)c1N(CCC(N(CC1)CCN1c(cc1)ccc1Cl)=O)C1=O)C1=O

InChI

InChI=1S/C24H25ClN4O3/c1-2-12-28-20-5-3-4-6-21(20)29(24(32)23(28)31)13-11-22(30)27-16-14-26(15-17-27)19-9-7-18(25)8-10-19/h2-10H,1,11-17H2

InChI Key

KDXVPMMCFRLSRN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27227370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.94

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.056

Distribution Coefficient, logD

3.056

Water Solubility, LogSw

-3.42

Polar Surface Area

50.404

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with L058-0596 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L058-0596?
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What is the minimum amount of L058-0596 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L058-0596
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L058-0596
  • 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 L058-0596 available by request