940999-53-1
Product Name:
4-Piperidinecarboxamide, 1-[4-cyano-2-[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]-5-oxazolyl]-
Formula:
C22H27N5O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 457.5 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 457.17837553 g/mol |
| Monoisotopic Mass | 457.17837553 g/mol |
| Topological Polar Surface Area | 142 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 798 |
| 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 |