Basic information
- CAS
37392-53-3- Standard SMILES
C[C@H](CCCN(C)C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C- InChIKey
LJQDDVJEZIEHNY-YIMUCPRWSA-N- Molecular formula
- C26H47N
- Average molar mass
- 373.7 g/mol
- Monoisotopic mass
- 373.3708505
Names & identifiers
- Preferred name
- 25-Azacholestane
- IUPAC
- (4R)-4-[(5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-N,N-dimethylpentan-1-amine
Names & synonyms
25-Azacholestane37392-53-3Cholan-24-amine, N,N-dimethyl-, (5alpha)-ASA 3
Database identifiers
- CAS
37392-53-3- PubChem CID
- 181523
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 512
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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