113559-13-0
Product Name:
E-4031
Formula:
C21H33Cl2N3O5S
Synonyms:
N-[4-[[1-[2-(6-Methyl-2-pyridinyl)ethyl]-4-piperidinyl]carbonyl]phenyl]methanesulfonamide dihydrochloride
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COMPUTED DESCRIPTORS
| Molecular Weight | 474.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 473.1306684 g/mol |
| Monoisotopic Mass | 473.1306684 g/mol |
| Topological Polar Surface Area | 87.8 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 603 |
| 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 | 3 |
| Compound Is Canonicalized | Yes |