149184-22-5
Product Name:
CGP 55845
Formula:
C18H23Cl3NO3P
Synonyms:
(2S)-3-[[(1S)-1-(3,4-Dichlorophenyl)ethyl]amino-2-hydro xypropyl](phenylmethyl)phosphinic acid hydrochloride;CGP 55845A;CGP55845
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COMPUTED DESCRIPTORS
| Molecular Weight | 438.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 8 |
| Exact Mass | 437.048114 g/mol |
| Monoisotopic Mass | 437.048114 g/mol |
| Topological Polar Surface Area | 69.6 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 448 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |