Basic information
- CAS
125494-59-9- Standard SMILES
CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1.Cl.O- InChIKey
KFNNPQDSPLWLCX-UHFFFAOYSA-N- Molecular formula
- C17H29Cl2NO
- Average molar mass
- 334.3 g/mol
- Monoisotopic mass
- 333.1626199
Overview
See also: Sibutramine Hydrochloride (annotation moved to); Sibutramine (annotation moved to) ... View More ...
Names & identifiers
- Preferred name
- Meridia
- IUPAC
- 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine;hydrate;hydrochloride
Names & synonyms
125494-59-9MeridiaSibutramine hydrochloride monohydrateReductilSibutramine hydrochloride hydrateSibutramine, Hydrochloride MonohydrateSibutramine hydrochloride [USAN]Meridia (TN)BTS-54524, Reductil, MeridiaC17H29Cl2NO1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine;hydrate;hydrochlorideDEA NO. 1675 (Hydrochloride)
Show more names
Sibutramine HCl monohydrate - Bio-X trade markSibutramine (hydrochloride monohydrate)Sibutramine hydrochloride monohydrate Solution in Methanol, 1000ug/mLSibutramine hydrochloride hydrate (JAN)Cyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-alpha-(2-methylpropyl)-, hydrochloride, hydrate (1:1:1)SIBUTRAMINE HYDROCHLORIDE HYDRATE [JAN]UNII-OGM0YHD1WFCPD000472527
Database identifiers
- CAS
125494-59-9- PubChem CID
- 64765
- DTXSID
DTXSID00925148- ChEMBL
CHEMBL3989830- UNII
- OGM0YHD1WF
Properties
Computed structural properties
- Topological polar surface area
- 4.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 275
Related reactions
16 records
Compound notes
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