Basic information
- Standard SMILES
CCCc1nc(C)n(-c2ccc3c(c2)C(O[Si](C(C)C)(C(C)C)C(C)C)CC(C)(C)O3)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1- InChIKey
XPXDQSBBHVGWAR-UHFFFAOYSA-N- Molecular formula
- C42H53N3O3Si
- Average molar mass
- 676 g/mol
Names & identifiers
- Preferred name
- 4'-[(1-{2,2-dimethyl-4-[(triisopropylsilyl)oxy]-3,4-dihydro-2H-chromen-6-yl}-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile
- IUPAC
- 2-[4-[[1-[2,2-dimethyl-4-tri(propan-2-yl)silyloxy-3,4-dihydrochromen-6-yl]-2-methyl-6-oxo-4-propylpyrimidin-5-yl]methyl]phenyl]benzonitrile
Names & synonyms
SCHEMBL1890118XPXDQSBBHVGWAR-UHFFFAOYSA-N4'-[(1-{2,2-dimethyl-4-[(triisopropylsilyl)oxy]-3,4-dihydro-2H-chromen-6-yl}-2-methyl-6-oxo-4-propyl-1,6-dihydropyrimidin-5-yl)methyl]biphenyl-2-carbonitrile
Database identifiers
- PubChem CID
- 57460409
Properties
Computed structural properties
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 1,250
Related reactions
5 records
Compound notes
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