192704-58-8
Product Name:
5,pregnane-7 alpha,21-dicarboxylic acid,17-ydroxy-11-methylsulfonic acid-3-ketone,-butyrolectone,methyl ester cas:(intermediate of eplerenone)
Formula:
C25H34O8S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 494.6 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 494.19743921 g/mol |
| Monoisotopic Mass | 494.19743921 g/mol |
| Topological Polar Surface Area | 121 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 1070 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |