Basic information
- Standard SMILES
CC1CCC(N)C(O)CN1S(=O)(=O)c1ccccn1- InChIKey
ZIGPWBCFIWAHKT-UHFFFAOYSA-N- Molecular formula
- C12H19N3O3S
- Average molar mass
- 285.36 g/mol
- Monoisotopic mass
- 285.11471265
Names & identifiers
- Preferred name
- 4-Amino-7-methyl-1-pyridin-2-ylsulfonylazepan-3-ol
- IUPAC
- 4-amino-7-methyl-1-pyridin-2-ylsulfonylazepan-3-ol
Database identifiers
- PubChem CID
- 22036698
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 396
Related reactions
2 records
Compound notes
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