6228-1512 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine

6228-1512 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine
6228-1512 Screening compound: 1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6228-1512
1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine

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

6228-1512

Molecular Formula

C24H23ClN2O5 (C24 H23 ClN2 O5)

Compound Name

1-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine

IUPAC name

1-[(2H-13-benzodioxol-5-yl)methyl]-4-{5-[(2-chlorophenoxy)methyl]furan-2-carbonyl}piperazine

SMILES

O=C(c1ccc(COc(cccc2)c2Cl)o1)N1CCN(Cc(cc2)cc3c2OCO3)CC1

InChI

InChI=1S/C24H23ClN2O5/c25-19-3-1-2-4-20(19)29-15-18-6-8-22(32-18)24(28)27-11-9-26(10-12-27)14-17-5-7-21-23(13-17)31-16-30-21/h1-8,13H,9-12,14-16H2

InChI Key

VBMWOZQJJGTERD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01919441

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

454.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.945

Distribution Coefficient, logD

3.758

Water Solubility, LogSw

-4.27

Polar Surface Area

52.698

Acid Dissociation Constant (pKa)

28.69

Base Dissociation Constant (pKb)

7.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

6228-1512 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 6228-1512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6228-1512?
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What is the minimum amount of 6228-1512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6228-1512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6228-1512
  • 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 6228-1512 available by request