929971-22-2
Product Name:
5,5-dioxo-3-[(E)-thiophen-2-ylmethylideneamino]-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-imine
Formula:
C10H11N3O2S3
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COMPUTED DESCRIPTORS
Molecular Weight | 301.4 g/mol |
---|---|
XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 301.00134012 g/mol |
Monoisotopic Mass | 301.00134012 g/mol |
Topological Polar Surface Area | 136 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 485 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |