866136-66-5
Product Name:
11-(4-benzylpiperazin-1-yl)-4-methyl-8-thia-12-azatetracyclo[8.8.0.0^{2,7}.0^{13,18}]octadeca-1(18),2,4,6,10,12,14,16-octaene
Formula:
C28H27N3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 437.6 g/mol |
|---|---|
| XLogP3 | 6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 437.19256905 g/mol |
| Monoisotopic Mass | 437.19256905 g/mol |
| Topological Polar Surface Area | 44.7 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 614 |
| 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 |