Dienogest

Chemical Information
Dienogest is a steroid hormone that is 17beta-hydroxy-3-oxoestra-4,9-diene substituted at position 17 by a cyanomethyl group. Used as an oral contraceptive. It has a role as a synthetic oral contraceptive, a progestin and a progesterone receptor agonist. It is a steroid hormone, a 17beta-hydroxy steroid, a 3-oxo-Delta(4) steroid and an aliphatic nitrile. It derives from a hydride of an estrane.
| CAS Number | 65928-58-7 |
| PubChem CID | 68861 |
| IUPAC Name | 2-[(8S,13S,14S,17R)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]acetonitrile |
| Molecular Formula | C20H25NO2 |
| Molecular Weight | 311.4 |
| XLogP | 1.8 |
| Topological Polar Surface Area | 61.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 679 |
| Property | Value |
|---|---|
| Molecular Weight | 311.4 |
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 311.188529040 |
| Monoisotopic Mass | 311.188529040 |
| Topological Polar Surface Area | 61.1 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 679 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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