Basic information
- CAS
64226-68-2- Standard SMILES
CC(=O)C1CCC2C3CC=C4CC(n5cc(F)c(=O)[nH]c5=O)CCC4(C)C3CCC12C- InChIKey
LKABFSOIFGBYOM-UHFFFAOYSA-N- Molecular formula
- C25H33FN2O3
- Average molar mass
- 428.5 g/mol
- Monoisotopic mass
- 428.24752108
Names & identifiers
- Preferred name
- 1-(17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl)-5-fluoropyrimidine-2,4-dione
- IUPAC
- 1-(17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl)-5-fluoropyrimidine-2,4-dione
Names & synonyms
NSC28183364226-68-2DTXSID90314289NSC-2818335-Fluoro-1-(20-oxopregn-5-en-3-yl)pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
64226-68-2- PubChem CID
- 323085
- DTXSID
DTXSID90314289
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 910
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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