Basic information
- Standard SMILES
COc1nc(NC(=O)OC(C)(C)C)cc(C)c1CNC(=O)c1cc(Br)cc2c1c(C)cn2C(C)C- InChIKey
YIFOUGJRBIFBHB-UHFFFAOYSA-N- Molecular formula
- C26H33BrN4O4
- Average molar mass
- 545.5 g/mol
- Monoisotopic mass
- 544.16852
Names & identifiers
- Preferred name
- tert-butyl (5-((6-bromo-1-isopropyl-3-methyl-1H-indole-4-carboxamido)methyl)-6-methoxy-4-methylpyridin-2-yl)carbamate
- IUPAC
- tert-butyl N-[5-[[(6-bromo-3-methyl-1-propan-2-ylindole-4-carbonyl)amino]methyl]-6-methoxy-4-methyl-2-pyridinyl]carbamate
Names & synonyms
SCHEMBL14727061YIFOUGJRBIFBHB-UHFFFAOYSA-Ntert-butyl (5-((6-bromo-1-isopropyl-3-methyl-1H-indole-4-carboxamido)methyl)-6-methoxy-4-methylpyridin-2-yl)carbamatetert-butyl(5-((6-bromo-1-isopropyl-3-methyl-1H-indole-4-carboxamido)methyl)-6-methoxy-4-methylpyridin-2-yl)carbamate
Database identifiers
- PubChem CID
- 71274276
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 745
Related reactions
12 records
Compound notes
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