165824-80-6
Product Name:
7-ANILINO-5-MORPHOLINO-3-PHENYL-1,4-THIAZEPINE-6-CARBONITRILE
Formula:
C22H20N4OS
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COMPUTED DESCRIPTORS
Molecular Weight | 388.5 g/mol |
---|---|
XLogP3 | 3.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 388.13578245 g/mol |
Monoisotopic Mass | 388.13578245 g/mol |
Topological Polar Surface Area | 86 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 687 |
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 |