875870-01-2
Product Name:
β-Alanine, N-(phenylsulfonyl)-, 2-[(2-chloro-4-methylphenyl)amino]-2-oxoethyl ester
Formula:
C18H19ClN2O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 410.9 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 9 |
| Exact Mass | 410.0703206 g/mol |
| Monoisotopic Mass | 410.0703206 g/mol |
| Topological Polar Surface Area | 110 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 601 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |