1-methyl-5-phenylmethoxy-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methylideneamino]indole-2-carboxamide
Basic information
- Standard SMILES
Cn1c(C(=O)NN=CC2OC3OC(C)(C)OC3C3OC(C)(C)OC23)cc2cc(OCc3ccccc3)ccc21- InChIKey
QBKHWTFIJZXXNR-UHFFFAOYSA-N- Molecular formula
- C29H33N3O7
- Average molar mass
- 535.6 g/mol
- Monoisotopic mass
- 535.2318504
Names & identifiers
- Preferred name
- 1-methyl-5-phenylmethoxy-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methylideneamino]indole-2-carboxamide
- IUPAC
- 1-methyl-5-phenylmethoxy-N-[(4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.02,6]dodecan-8-yl)methylideneamino]indole-2-carboxamide
Database identifiers
- PubChem CID
- 334466
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 923
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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