3466-0004 Screening compound: [4-(TERT-BUTYL)PHENYL](4-PHENYLPIPERAZINO)METHANETHIONE

3466-0004 Screening compound: [4-(TERT-BUTYL)PHENYL](4-PHENYLPIPERAZINO)METHANETHIONE
3466-0004 Screening compound: [4-(TERT-BUTYL)PHENYL](4-PHENYLPIPERAZINO)METHANETHIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3466-0004
[4-(TERT-BUTYL)PHENYL](4-PHENYLPIPERAZINO)METHANETHIONE

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

3466-0004

Molecular Formula

C21H26N2S (C21 H26 N2 S)

Compound Name

[4-(TERT-BUTYL)PHENYL](4-PHENYLPIPERAZINO)METHANETHIONE

IUPAC name

n/a

SMILES

CC(C)(C)c(cc1)ccc1C(N(CC1)CCN1c1ccccc1)=S

InChI

InChI=1S/C21H26N2S/c1-21(2,3)18-11-9-17(10-12-18)20(24)23-15-13-22(14-16-23)19-7-5-4-6-8-19/h4-12H,13-16H2,1-3H3

InChI Key

DPLSPECGBKTIFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02355571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.52

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.815

Distribution Coefficient, logD

5.815

Water Solubility, LogSw

-5.81

Polar Surface Area

5.447

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

5.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.00

3466-0004 in Drug Discovery

Included in Screening Libraries

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 3466-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3466-0004?
Check Price and Availability of 3466-0004, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3466-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3466-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3466-0004
  • 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 3466-0004 available by request