157707-95-4
Product Name:
L-Alanine, N-5-(acetylamino)-2-chloro-4-(2-cyano-4-nitrophenyl)azophenyl-, methyl ester
Formula:
C19H17ClN6O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 444.8 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 444.0948954 g/mol |
| Monoisotopic Mass | 444.0948954 g/mol |
| Topological Polar Surface Area | 162 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 750 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |