Basic information
- Standard SMILES
Cn1c(C(=O)N[C@H](CO)Cc2ccccc2)cc2c(OCc3ccccc3)cccc21- InChIKey
JTQHWRXNNVYBQY-NRFANRHFSA-N- Molecular formula
- C26H26N2O3
- Average molar mass
- 414.5 g/mol
- Monoisotopic mass
- 414.1943427
Names & identifiers
- Preferred name
- (S)-N-[1-benzyl-2-hydroxyethyl]-4-(benzyloxy)-1-methyl-1H-indole-2-carboxamide
- IUPAC
- N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-1-methyl-4-phenylmethoxyindole-2-carboxamide
Names & synonyms
SCHEMBL5008053JTQHWRXNNVYBQY-NRFANRHFSA-N(S)-N-[1-benzyl-2-hydroxyethyl]-4-(benzyloxy)-1-methyl-1H-indole-2-carboxamide
Database identifiers
- PubChem CID
- 69276702
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 559
Related reactions
2 records
Compound notes
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