8018-3189 Screening compound: 3-(2,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine

8018-3189 Screening compound: 3-(2,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
8018-3189 Screening compound: 3-(2,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3189
3-(2,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-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

8018-3189

Molecular Formula

C10H7Cl2N5S (C10 H7 Cl2 N5 S)

Compound Name

3-(2,4-dichlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine

IUPAC name

3-(24-dichlorophenyl)-7H-[124]triazolo[34-b][134]thiadiazin-6-amine

SMILES

NC(CS1)=Nn2c1nnc2-c(ccc(Cl)c1)c1Cl

InChI

InChI=1S/C10H7Cl2N5S/c11-5-1-2-6(7(12)3-5)9-14-15-10-17(9)16-8(13)4-18-10/h1-3H,4H2,(H2,13,16)

InChI Key

XSXGUKDRZFNTBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07657914

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.17

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.611

Distribution Coefficient, logD

2.592

Water Solubility, LogSw

-3.69

Polar Surface Area

55.182

Acid Dissociation Constant (pKa)

15.10

Base Dissociation Constant (pKb)

6.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8018-3189 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-3189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3189?
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What is the minimum amount of 8018-3189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3189
  • 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 8018-3189 available by request