Basic information
- Standard SMILES
CCCc1nc(-n2c(C)ccc2C)c(C=O)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1- InChIKey
UFKVTHMBSYHKSC-UHFFFAOYSA-N- Molecular formula
- C46H41N7O
- Average molar mass
- 707.9 g/mol
- Monoisotopic mass
- 707.33725896
Names & identifiers
- Preferred name
- 4-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-propyl-1-[[2'-(N-triphenylmethyl-tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-1H-imidazole-5-carboxaldehyde
- IUPAC
- 5-(2,5-dimethylpyrrol-1-yl)-2-propyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbaldehyde
Names & synonyms
SCHEMBL9208011UFKVTHMBSYHKSC-UHFFFAOYSA-N4-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-propyl-1-[[2'-(N-triphenylmethyl-tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-1H-imidazole-5-carboxaldehyde
Database identifiers
- PubChem CID
- 19106920
Properties
Computed structural properties
- XLogP
- 9.8
- Topological polar surface area
- 83.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,100
Related reactions
4 records
Compound notes
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