35849-45-7
Product Name:
ethyl N2-[3-[bis(2-chloroethyl)amino]-N-(4-fluoro-3-phenyl-L-alanyl)-3-phenyl-L-alanyl]-L-asparaginate monohydrochloride
Formula:
C28H37Cl3FN5O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 649.0 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 18 |
| Exact Mass | 647.184431 g/mol |
| Monoisotopic Mass | 647.184431 g/mol |
| Topological Polar Surface Area | 157 Ų |
| Heavy Atom Count | 42 |
| Formal Charge | 0 |
| Complexity | 837 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |