ethyl ((1S)-5-{2-[2-(4-isopropylphenyl)-5-methyl-1,3-thiazol-4-yl]ethoxy}-2,3-dihydro-1h-inden-1-yl)acetate
Basic information
- Standard SMILES
CCOC(=O)C[C@@H]1CCc2cc(OCCc3nc(-c4ccc(C(C)C)cc4)sc3C)ccc21- InChIKey
NUTNHZDTRTYUSI-QHCPKHFHSA-N- Molecular formula
- C28H33NO3S
- Average molar mass
- 463.6 g/mol
- Monoisotopic mass
- 463.21811509
Names & identifiers
- Preferred name
- ethyl ((1S)-5-{2-[2-(4-isopropylphenyl)-5-methyl-1,3-thiazol-4-yl]ethoxy}-2,3-dihydro-1h-inden-1-yl)acetate
- IUPAC
- ethyl 2-[(1S)-5-[2-[5-methyl-2-(4-propan-2-ylphenyl)-1,3-thiazol-4-yl]ethoxy]-2,3-dihydro-1H-inden-1-yl]acetate
Names & synonyms
SCHEMBL821108NUTNHZDTRTYUSI-QHCPKHFHSA-Nethyl ((1S)-5-{2-[2-(4-isopropylphenyl)-5-methyl-1,3-thiazol-4-yl]ethoxy}-2,3-dihydro-1h-inden-1-yl)acetate
Database identifiers
- PubChem CID
- 10195367
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 620
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Related reactions
1 records
Compound notes
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