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CS-W001157 4
Total: USD 88.00

5-Benzyl-1,3,4-thiadiazol-2(3h)-imine

  • CAS No. 16502-08-2

  • Cat. No. CS-0269919
  • Molecule weight191.25
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

5-Benzyl-1,3,4-thiadiazol-2(3h)-imine|CS-0269919

Structure of 16502-08-2

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General Information

  • CAS No. 16502-08-2
  • Cat. No. CS-0269919
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉N₃S
  • Molecular Weight 191.25
  • Synonym(s) 5-Benzyl-1,3,4-thiadiazol-2-amine
  • SMILES C1=CC=C(C=C1)CC2=NNC(=N)S2

Description

5-Benzyl-1,3,4-thiadiazol-2(3H)-imine features a fused heterocyclic core with a benzyl group at the 5-position, delivering enhanced solubility and electronic modulation. The imine functionality enables direct incorporation into bioactive scaffolds, while the thiadiazole ring imparts metabolic stability and favorable binding interactions in medicinal chemistry applications.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.53
  • LogP   1.54147
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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