184951-89-1
Product Name:
BOC-THIONOSER(BZL)-1-(6-NITRO)BENZOTRIAZOLIDE
Formula:
C21H23N5O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 457.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 8 |
| Exact Mass | 457.14199002 g/mol |
| Monoisotopic Mass | 457.14199002 g/mol |
| Topological Polar Surface Area | 156 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 677 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |