5722-1259 Screening compound: 4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one

5722-1259 Screening compound: 4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one
5722-1259 Screening compound: 4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5722-1259
4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one

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

5722-1259

Molecular Formula

C14H16BrNOS (C14 H16 BrNOS)

Compound Name

4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one

IUPAC name

4-(4-bromophenyl)-1-thia-4-azaspiro[4.5]decan-3-one

SMILES

O=C(CSC12CCCCC2)N1c(cc1)ccc1Br

InChI

InChI=1S/C14H16BrNOS/c15-11-4-6-12(7-5-11)16-13(17)10-18-14(16)8-2-1-3-9-14/h4-7H,1-3,8-10H2

InChI Key

UYJZMBWICOIZIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03687355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.914

Distribution Coefficient, logD

3.914

Water Solubility, LogSw

-3.91

Polar Surface Area

16.112

Acid Dissociation Constant (pKa)

16.28

Base Dissociation Constant (pKb)

-8.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

5722-1259 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5722-1259 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5722-1259?
Check Price and Availability of 5722-1259, 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 5722-1259 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5722-1259
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5722-1259
  • 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 5722-1259 available by request