60431-65-4
Product Name:
3-[(P-NITROANILINO)METHYL]-2-BENZOTHIAZOLINETHIONE
Formula:
C14H11N3O2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 317.4 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 317.02926895 g/mol |
Monoisotopic Mass | 317.02926895 g/mol |
Topological Polar Surface Area | 119 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 408 |
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 |