Basic information
- Standard SMILES
COc1ccc2oc(C(=O)NC(CC(C)C)C(=O)NC3CC(C)CN(S(=O)(=O)c4ccccn4)CC3O)cc2c1- InChIKey
BZXUYHZBHCBSNU-UHFFFAOYSA-N- Molecular formula
- C28H36N4O7S
- Average molar mass
- 572.7 g/mol
- Monoisotopic mass
- 572.23047067
Names & identifiers
- IUPAC
- N-[1-[(3-hydroxy-6-methyl-1-pyridin-2-ylsulfonylazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]-5-methoxy-1-benzofuran-2-carboxamide
Database identifiers
- PubChem CID
- 77742167
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 974
Related reactions
1 records
Compound notes
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