72836-33-0
Product Name:
2-AMINO-5-(4-CHLOROBENZYLTHIO)1,3,4-THIADIAZOLE
Formula:
C9H8ClN3S2
Synonyms:
5-((4-Chlorobenzyl)sulfanyl)-1,3,4-thiadiazol-2-amine, Virulence Regulator RegA Inhibitor, NSC-523933;Regacin - CAS 72836-33-0 - Calbiochem
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COMPUTED DESCRIPTORS
| Molecular Weight | 257.8 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 256.9848173 g/mol |
| Monoisotopic Mass | 256.9848173 g/mol |
| Topological Polar Surface Area | 105 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 200 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-amine is an aryl sulfide.