Basic information
- Standard SMILES
CN1CCN(CCCSn2c3c(c4ccccc42)COCC3)CC1- InChIKey
CSKHMLDNNLLSOZ-UHFFFAOYSA-N- Molecular formula
- C19H27N3OS
- Average molar mass
- 345.5 g/mol
- Monoisotopic mass
- 345.18748367
Names & identifiers
- Preferred name
- 5-[3-(4-methylpiperazin-1-yl)propylsulfanyl]-3,4-dihydro-1H-pyrano[4,3-b]indole
- IUPAC
- 5-[3-(4-methylpiperazin-1-yl)propylsulfanyl]-3,4-dihydro-1H-pyrano[4,3-b]indole
Database identifiers
- PubChem CID
- 200024
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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