Basic information
- Standard SMILES
O=S1(=O)CCN2C=CC=C(c3ccc(OC4CCCCCC4)cc3)C2=N1- InChIKey
BZBGECWBHXGDQK-UHFFFAOYSA-N- Molecular formula
- C20H24N2O3S
- Average molar mass
- 372.5 g/mol
- Monoisotopic mass
- 372.15076381
Names & identifiers
- Preferred name
- 9-[4-(Cycloheptyloxy)phenyl]-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine 2,2-dioxide
- IUPAC
- 9-(4-cycloheptyloxyphenyl)-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine 2,2-dioxide
Names & synonyms
SCHEMBL625156BZBGECWBHXGDQK-UHFFFAOYSA-N9-[4-(cycloheptyloxy)phenyl]-3,4-dihydropyrido[2,1-c][1,2,4]thiadiazine 2,2-dioxide
Database identifiers
- PubChem CID
- 66748706
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 689
Related reactions
5 records
Compound notes
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