Basic information
- CAS
105149-59-5- Standard SMILES
Brc1ccc(C2(N3CCCCC3)CCCCC2)s1- InChIKey
ZJSLJZMJNFSODC-UHFFFAOYSA-N- Molecular formula
- C15H22BrNS
- Average molar mass
- 328.3 g/mol
- Monoisotopic mass
- 327.06563
Names & identifiers
- Preferred name
- Piperidine, 1-[1-(5-bromo-2-thienyl)cyclohexyl]-
- IUPAC
- 1-[1-(5-bromothiophen-2-yl)cyclohexyl]piperidine
Names & synonyms
Piperidine, 1-[1-(5-bromo-2-thienyl)cyclohexyl]-105149-59-51-[1-(5-bromothiophen-2-yl)cyclohexyl]piperidineNCI60_038483CHEMBL2007829DTXSID00327981AKOS005066687
Database identifiers
- CAS
105149-59-5- PubChem CID
- 398715
- DTXSID
DTXSID00327981- ChEMBL
CHEMBL2007829
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 31.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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