2-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]naphthalene-1-sulfinamide
Basic information
- CAS
339107-04-9- Standard SMILES
COc1ccc2ccccc2c1S(=O)Nc1ccc(N2CCN(C)CC2)cc1- InChIKey
ALIMEBYZQDJQLY-UHFFFAOYSA-N- Molecular formula
- C22H25N3O2S
- Average molar mass
- 395.5 g/mol
Names & identifiers
- Preferred name
- 2-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]naphthalene-1-sulfinamide
- IUPAC
- 2-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]naphthalene-1-sulfinamide
- English name
- 2-Methoxy-N-[4-(4-methylpiperazino)phenyl]-1-naphthalenesulfinamide
- Molecular formula
- C22H25N3O2S
- Molecular weight
- 395.52
Names & synonyms
2-methoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]naphthalene-1-sulfinamide339107-04-9Oprea1_7577322-methoxy-N-[4-(4-methylpiperazino)phenyl]-1-naphthalenesulfinamideAKOS0051017198N-8121-Naphthalenesulfinamide, 2-methoxy-N-[4-(4-methyl-1-piperazinyl)phenyl]-
Database identifiers
- CAS
339107-04-9
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 64 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 518
Physicochemical properties
- Boiling point
- 613 · 613.0±65.0 °C(Predicted)
- Density
- 1.32 · 1.32±0.1 g/cm3(Predicted)
- pka
- 7.61 · 7.61±0.60(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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