8014-6019 Screening compound: 3-(tert-butyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

8014-6019 Screening compound: 3-(tert-butyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
8014-6019 Screening compound: 3-(tert-butyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-6019
3-(tert-butyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

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

8014-6019

Molecular Formula

C14H15ClN4S (C14 H15 ClN4 S)

Compound Name

3-(tert-butyl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

IUPAC name

3-tert-butyl-6-(4-chlorophenyl)-7H-[124]triazolo[34-b][134]thiadiazine

SMILES

CC(C)(C)c1nnc2SCC(c(cc3)ccc3Cl)=Nn12

InChI

InChI=1S/C14H15ClN4S/c1-14(2,3)12-16-17-13-19(12)18-11(8-20-13)9-4-6-10(15)7-5-9/h4-7H,8H2,1-3H3

InChI Key

HOGQLKVDOKUHKZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07656896

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

306.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.239

Water Solubility, LogSw

-4.60

Polar Surface Area

34.230

Acid Dissociation Constant (pKa)

19.07

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.71

8014-6019 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8014-6019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-6019?
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What is the minimum amount of 8014-6019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-6019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-6019
  • 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 8014-6019 available by request