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Basic information
- CAS
42408-80-0- Standard SMILES
CCn1c2c(c3ccccc31)CCSC2(C)CCN(C)C- InChIKey
BRPOADLGOFPKKJ-UHFFFAOYSA-N- Molecular formula
- C18H26N2S
- Average molar mass
- 302.5 g/mol
- Monoisotopic mass
- 302.18167001
Names & identifiers
- Preferred name
- Tandamine
- IUPAC
- 2-(9-ethyl-1-methyl-3,4-dihydrothiopyrano[3,4-b]indol-1-yl)-N,N-dimethylethanamine
- English name
- Tandamine
- Molecular formula
- C18H26N2S
- Molecular weight
- 302.48
Names & synonyms
Tandamine42408-80-0TandaminaTandaminum6L5FH5A43EDTXSID708660949-Ethyl-1,3,4,9-tetrahydro-N,N,1-trimethylthiopyrano(3,4-b)indole-1-ethanamineRefChem:932554DTXCID20814424(2-(9-ethyl-1-methyl-1H,3H,4H,9H-thiopyrano(3,4-b)indol-1-yl)ethyl)dimethylamine1-(2-(dimethylamino)ethyl)-9-ethyl-1,3,4,9-tetrahydro-1-methylthiopyrano(3,4-b)indoleTandamine [INN]
Show more names
9-Ethyl-1,3,4,9-tetrahydro-N,N,1-trimethyl(thiopyrano[3,4-b]indole)-1-ethanamineThiopyrano[3,4-b]indole-1-ethanamine, 9-ethyl-1,3,4,9-tetrahydro-N,N,1-trimethyl-
Tandamine, (+)-Tandamine, (-)-2-(9-ethyl-1-methyl-3,4-dihydrothiopyrano[3,4-b]indol-1-yl)-N,N-dimethylethanamineP8Q86YNB85D38V2K62U7NSC305532AY-23,946Thiopyrano(3,4-b)indole-1-ethanamine, 9-ethyl-1,3,4,9-tetrahydro-N,N,1-trimethyl-, (+)-
Database identifiers
- CAS
42408-80-0、58167-78-5、62481-65-6、62481-67-8- PubChem CID
- 39187
- DTXSID
DTXSID70866094- ChEMBL
CHEMBL2110652- UNII
- 6L5FH5A43E、D38V2K62U7、P8Q86YNB85
- Nikkaji
- J16.877G
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 359
Physicochemical properties
- FDA UNII
- 6 L5FH5A43E · 6L5FH5A43E
Chemistry & industry
Applications
UsesAntidepressant.
Suppliers1 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
5 records
Compound notes
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