Basic information
- Standard SMILES
COc1ccc(C(C)(C)CNc2cc(OC)c(OC)cc2C(=O)c2ccc(C(C)C)cc2)cc1OC- InChIKey
OTHITBFHNVZUGG-UHFFFAOYSA-N- Molecular formula
- C30H37NO5
- Average molar mass
- 491.6 g/mol
- Monoisotopic mass
- 491.26717328
Names & identifiers
- Preferred name
- {2-[2-(3,4-Dimethoxy-phenyl)-2-methyl-propylamino]-4,5-dimethoxy-phenyl}-(4-isopropyl-phenyl)-methanone
- IUPAC
- [2-[[2-(3,4-dimethoxyphenyl)-2-methylpropyl]amino]-4,5-dimethoxyphenyl]-(4-propan-2-ylphenyl)methanone
Names & synonyms
SCHEMBL3277992OTHITBFHNVZUGG-UHFFFAOYSA-N{2-[2-(3,4-Dimethoxy-phenyl)-2-methyl-propylamino]-4,5-dimethoxy-phenyl}-(4-isopropyl-phenyl)-methanone
Database identifiers
- PubChem CID
- 59259031
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 674
Related reactions
3 records
Compound notes
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