62113-49-9
Product Name:
3,8-BIS-ETHOXYCARBONYLAMINO-5-(3-BROMO-PROPYL)-6-PHENYL -PHENANTHRIDINIUM BROMIDE
Formula:
C28H29Br2N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 631.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 10 |
| Exact Mass | 631.05043 g/mol |
| Monoisotopic Mass | 629.05248 g/mol |
| Topological Polar Surface Area | 80.5 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 719 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |