8012-4212 Screening compound: 1-(4-bromobenzoyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine

8012-4212 Screening compound: 1-(4-bromobenzoyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine
8012-4212 Screening compound: 1-(4-bromobenzoyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-4212
1-(4-bromobenzoyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]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

8012-4212

Molecular Formula

C16H18BrN3OS (C16 H18 BrN3 OS)

Compound Name

1-(4-bromobenzoyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]piperazine

IUPAC name

1-(4-bromobenzoyl)-4-[(2-methyl-13-thiazol-4-yl)methyl]piperazine

SMILES

Cc1nc(CN(CC2)CCN2C(c(cc2)ccc2Br)=O)cs1

InChI

InChI=1S/C16H18BrN3OS/c1-12-18-15(11-22-12)10-19-6-8-20(9-7-19)16(21)13-2-4-14(17)5-3-13/h2-5,11H,6-10H2,1H3

InChI Key

GLQCQVXEEBXBMT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02934914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.725

Distribution Coefficient, logD

2.720

Water Solubility, LogSw

-2.79

Polar Surface Area

30.734

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

8012-4212 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8012-4212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-4212?
Check Price and Availability of 8012-4212, 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 8012-4212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-4212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-4212
  • 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 8012-4212 available by request