Basic information
- CAS
89664-18-6- Standard SMILES
CN1Cc2c(N)cccc2[C@H](c2ccccc2)C1- InChIKey
XXPANQJNYNUNES-AWEZNQCLSA-N- Molecular formula
- C16H18N2
- Average molar mass
- 238.33 g/mol
- Monoisotopic mass
- 238.14699858
Overview
(S)-nomifensine is the S enantiomer of nomifensine. It is an enantiomer of a (R)-nomifensine.
Names & identifiers
- Preferred name
- (S)-Nomifensine
- IUPAC
- (4S)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-amine
- English name
- (S)-nomifensine
- Molecular formula
- C16H18N2
- Molecular weight
- 238.33
Names & synonyms
(S)-Nomifensine(4S)-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amineCHEBI:180847RefChem:1051206(-)-Nomifensine(-)-Nomiphensinenomifensine (S)89664-18-6Nomifensine, (S)-KLC3B8H9LECHEMBL51697(S)-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amine
Show more names
8-Isoquinolinamine, 1,2,3,4-tetrahydro-2-methyl-4-phenyl-, (4S)-
(S)-1,2,3,4-tetrahydro-2-methyl-4-phenyl-8-isoquinolinamineBRN 6064060(S)-1,2,3,4-Tetrahydro-2-methyl-4-phenyl-8-isoquinolineUNII-KLC3B8H9LELopac-N-15308-ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-METHYL-4-PHENYL-, (S)-Epitope ID:116874A1LX5
Database identifiers
- CAS
89664-18-6- PubChem CID
- 55993
- DTXSID
DTXSID801316995- ChEMBL
CHEMBL51697- ChEBI
CHEBI:180847- UNII
- KLC3B8H9LE
- Nikkaji
- J293.622D
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- FDA UNII
- 3 B8H9LE · KLC3B8H9LE
Chemistry & industry
Suppliers1 total
湖北扬信医药科技有限公司15347293736 · [email protected]
Additional notes
DefinitionChEBI: (S)-nomifensine is the S enantiomer of nomifensine. It is an enantiomer of a (R)-nomifensine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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