956953-24-5
Product Name:
(1S)-3-(2-hydroxy-3-((3-hydroxyphenyl)amino)propyl)-3,4,5,6-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-8(2H)-one
Formula:
C20H25N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 355.4 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 355.18959167 g/mol |
| Monoisotopic Mass | 355.18959167 g/mol |
| Topological Polar Surface Area | 76 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 591 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |