3247-70-9
Product Name:
2-CHLOROMETHYL-5-(4-CHLOROPHENYL)-1,3,4-THIADIAZOLE
Formula:
C4H6N2S
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COMPUTED DESCRIPTORS
Molecular Weight | 114.17 g/mol |
---|---|
XLogP3 | 0.1 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 0 |
Exact Mass | 114.02516937 g/mol |
Monoisotopic Mass | 114.02516937 g/mol |
Topological Polar Surface Area | 56.2 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 128 |
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 |