N-[3-(methylsulfanyl)benzyl]-N-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl]amine
Basic information
- Standard SMILES
CSc1cccc(CN[C@H]2CCCc3ccccc32)c1- InChIKey
AXSVMTINIHJJFZ-SFHVURJKSA-N- Molecular formula
- C18H21NS
- Average molar mass
- 283.4 g/mol
- Monoisotopic mass
- 283.13947085
Names & identifiers
- Preferred name
- N-[3-(methylsulfanyl)benzyl]-N-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl]amine
- IUPAC
- (1S)-N-[(3-methylsulfanylphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
Names & synonyms
SCHEMBL6253650AXSVMTINIHJJFZ-SFHVURJKSA-NN-[3-(methylsulfanyl)benzyl]-N-[(1S)-1,2,3,4-tetrahydro-1-naphthalenyl]amine
Database identifiers
- PubChem CID
- 69721790
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 293
Related reactions
1 records
Compound notes
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