Basic information
- CAS
17531-98-5- Standard SMILES
Br.CC(CN1CCCCC1)C(O)(c1ccsc1)c1ccsc1- InChIKey
OUAYZPBTANAXRR-UHFFFAOYSA-N- Molecular formula
- C17H24BrNOS2
- Average molar mass
- 402.4 g/mol
- Monoisotopic mass
- 401.04827
Names & identifiers
- Preferred name
- 1-Propanol, 1,1-di(thien-3-yl)-2-methyl-3-piperidino-, hydrobromide
- IUPAC
- 2-methyl-3-piperidin-1-yl-1,1-di(thiophen-3-yl)propan-1-ol;hydrobromide
Names & synonyms
17531-98-51-Propanol, 1,1-di(thien-3-yl)-2-methyl-3-piperidino-, hydrobromideRefChem:10568921,1-Dithien-3-yl-2-methyl-3-piperidino-1-propanol hydrobromideDTXSID709386492-Methyl-3-(piperidin-1-yl)-1,1-di(thiophen-3-yl)propan-1-ol--hydrogen bromide (1/1)
Database identifiers
- CAS
17531-98-5- PubChem CID
- 205170
- DTXSID
DTXSID70938649
Properties
Computed structural properties
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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