69194-32-7
Product Name:
2H-Pyrazolo(4,3-c)pyridine, 3,3a,4,5,6,7-hexahydro-5-methyl-5-phenyl-7 -(phenylmethylene)-2-propyl-, phosphate, hydrate (1:1:1)
Formula:
C23H28N3.H2O.H2O4P
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COMPUTED DESCRIPTORS
| Molecular Weight | 443.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 443.19739344 g/mol |
| Monoisotopic Mass | 443.19739344 g/mol |
| Topological Polar Surface Area | 96.6 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 575 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |