Basic information
- CAS
29903-68-2- Standard SMILES
COc1cc2c(cc1OC)C(CCc1ccccc1)NCC2- InChIKey
ZSTCPHVBMNDKEB-UHFFFAOYSA-N- Molecular formula
- C19H23NO2
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.17287898
Names & identifiers
- Preferred name
- 6,7-Dimethoxy-1-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinoline
- IUPAC
- 6,7-dimethoxy-1-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinoline
- English name
- 1,2,3,4-tetrahydro-6,7-dimethoxy-1-(2-phenylethyl)isoquinoline
- Molecular formula
- C19H23NO2
- Molecular weight
- 297.39
Names & synonyms
29903-68-26,7-dimethoxy-1-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinolineDTXSID00952358RefChem:1073591DTXCID5013804521,2,3,4-Tetrahydro-6,7-dimethoxy-1-phenethylisoquinoline6,7-dimethoxy-1-phenethyl-1,2,3,4-tetrahydroisoquinolineMFCD01747244ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1-PHENETHYL-SCHEMBL6374574ZSTCPHVBMNDKEB-UHFFFAOYSA-NAKOS015946000
Show more names
1,2,3,4-tetrahydro-6,7-dimethoxy-1-(2-phenylethyl)isoquinolineIsoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-1-(2-phenylethyl)-
DA-30391NS-050236,7-dimethoxy-1-phenethyl-1,2,3,4-tetrahydro-isoquinoline1-(2-Phenyl-ethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Database identifiers
- CAS
29903-68-2- PubChem CID
- 34754
- DTXSID
DTXSID00952358- Nikkaji
- J2.450.435B
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 329
Chemistry & industry
Applications
Uses6,7-Dimethoxy-1-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinoline is used in preparation of tetrahydroisoquinoline ureas and related derivatives as urotensin II receptor antagonists.
Suppliers1 total
南京世洲生物科技有限公司17301488900 · [email protected]
Related reactions
4 records
Compound notes
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