3405-0203 Screening compound: 2-(piperidine-1-carbothioyl)phenol

3405-0203 Screening compound: 2-(piperidine-1-carbothioyl)phenol
3405-0203 Screening compound: 2-(piperidine-1-carbothioyl)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3405-0203
2-(piperidine-1-carbothioyl)phenol

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

3405-0203

Molecular Formula

C12H15NOS (C12 H15 NOS)

Compound Name

2-(piperidine-1-carbothioyl)phenol

IUPAC name

2-(piperidine-1-carbothioyl)phenol

SMILES

Oc(cccc1)c1C(N1CCCCC1)=S

InChI

InChI=1S/C12H15NOS/c14-11-7-3-2-6-10(11)12(15)13-8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2

InChI Key

FDEJXMBAYGPUFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01062094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

221.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.591

Distribution Coefficient, logD

3.590

Water Solubility, LogSw

-3.24

Polar Surface Area

18.735

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.67

3405-0203 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 3405-0203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3405-0203?
Check Price and Availability of 3405-0203, 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 3405-0203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3405-0203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3405-0203
  • 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 3405-0203 available by request