3466-0013 Screening compound: 1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)piperazine

3466-0013 Screening compound: 1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)piperazine
3466-0013 Screening compound: 1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3466-0013
1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)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

3466-0013

Molecular Formula

C19H22N2OS (C19 H22 N2 OS)

Compound Name

1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)piperazine

IUPAC name

1-(4-methoxybenzenecarbothioyl)-4-(2-methylphenyl)piperazine

SMILES

Cc(cccc1)c1N(CC1)CCN1C(c(cc1)ccc1OC)=S

InChI

InChI=1S/C19H22N2OS/c1-15-5-3-4-6-18(15)20-11-13-21(14-12-20)19(23)16-7-9-17(22-2)10-8-16/h3-10H,11-14H2,1-2H3

InChI Key

JERFSNBUZIQBCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02333054

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.626

Distribution Coefficient, logD

4.626

Water Solubility, LogSw

-4.29

Polar Surface Area

12.690

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

3466-0013 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3466-0013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3466-0013?
Check Price and Availability of 3466-0013, 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 3466-0013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3466-0013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3466-0013
  • 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 3466-0013 available by request