Basic information
- CAS
36063-63-5- Standard SMILES
CN1CCN(C(=O)c2c3c(nc4ccccc24)CCCCC3)CC1- InChIKey
NLMDZXBADJRYLC-UHFFFAOYSA-N- Molecular formula
- C20H25N3O
- Average molar mass
- 323.4 g/mol
- Monoisotopic mass
- 323.19976243
Names & identifiers
- Preferred name
- Piperazine, 1-methyl-4-((7,8,9,10-tetrahydro-6H-cyclohepta(b)quinolin-11-yl)carbonyl)-
- IUPAC
- (4-methylpiperazin-1-yl)-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)methanone
Names & synonyms
36063-63-5BRN 0823735Piperazine, 1-methyl-4-((7,8,9,10-tetrahydro-6H-cyclohepta(b)quinolin-11-yl)carbonyl)-4-((7,8,9,10-Tetrahydro-6H-cyclohepta(b)quinolin-11-yl)carbonyl)-1-methylpiperazineDTXSID90189636RefChem:372583DTXCID50112127(4-methylpiperazin-1-yl)(7,8,9,10-tetrahydro-6h-cyclohepta[b]quinolin-11-yl)methanone
Database identifiers
- CAS
36063-63-5- PubChem CID
- 215670
- DTXSID
DTXSID90189636
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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