1463-0082 Screening compound: 5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine

1463-0082 Screening compound: 5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine
1463-0082 Screening compound: 5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1463-0082
5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine

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

1463-0082

Molecular Formula

C9H9N3OS (C9 H9 N3 OS)

Compound Name

5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine

IUPAC name

5-(phenoxymethyl)-134-thiadiazol-2-amine

SMILES

Nc1nnc(COc2ccccc2)s1

InChI

InChI=1S/C9H9N3OS/c10-9-12-11-8(14-9)6-13-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,12)

InChI Key

CLQBSPRBHILXIC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

207.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.359

Distribution Coefficient, logD

1.359

Water Solubility, LogSw

-1.73

Polar Surface Area

52.263

Acid Dissociation Constant (pKa)

17.66

Base Dissociation Constant (pKb)

7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1463-0082 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 1463-0082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1463-0082?
Check Price and Availability of 1463-0082, 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 1463-0082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1463-0082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1463-0082
  • 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 1463-0082 available by request