86758-95-4
Product Name:
1-Piperazinamine, 4-(10,11-dihydrodibenzo(b,f)thiepin-10-yl)-N-((4-(di methylamino)phenyl)methylene)-
Formula:
C27H30N4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 442.6 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 442.21911815 g/mol |
| Monoisotopic Mass | 442.21911815 g/mol |
| Topological Polar Surface Area | 47.4 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 609 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |