Basic information
- Standard SMILES
CCOc1c(CN2CCCCC2)c2c(c3c1OC(C)(C)C3)C(c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1)=NC(C)(C)C2- InChIKey
VVWSECYCLSEPLG-UHFFFAOYSA-N- Molecular formula
- C31H43N3O6S2
- Average molar mass
- 617.8 g/mol
Names & identifiers
- Preferred name
- N-[3-[6-Ethoxy-3,4,8,9-tetrahydro-3,3,8,8-tetramethyl-5-[(1-piperidinyl)methyl]furo[2,3-h]isoquinolin-1-yl]phenyl]-N-(methylsulfonyl)methanesulfonamide
- IUPAC
- N-[3-[6-ethoxy-3,3,8,8-tetramethyl-5-(piperidin-1-ylmethyl)-4,9-dihydrofuro[2,3-h]isoquinolin-1-yl]phenyl]-N-methylsulfonylmethanesulfonamide
Names & synonyms
SCHEMBL5783971VVWSECYCLSEPLG-UHFFFAOYSA-NN-[3-[6-Ethoxy-3,4,8,9-tetrahydro-3,3,8,8-tetramethyl-5-[(1-piperidinyl)methyl]furo[2,3-h]isoquinolin-1-yl]phenyl]-N-(methylsulfonyl)methanesulfonamide
Database identifiers
- PubChem CID
- 22344045
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,180
Related reactions
1 records
Compound notes
Loading…