254982-11-1
Product Name:
METHYL 3-AMINO-8-CHLORO-4H-BENZO[B]THIENO[2,3-D]THIINE-2-CARBOXYLATE
Formula:
C13H10ClNO2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 311.8 g/mol |
---|---|
XLogP3 | 4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 310.9841486 g/mol |
Monoisotopic Mass | 310.9841486 g/mol |
Topological Polar Surface Area | 106 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 371 |
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 |