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Basic information
- Standard SMILES
CC1CCc2ncnc(N3CC4(CCN(CCCN)CC4)c4cc(Cl)ccc43)c21- InChIKey
GVRMLHVGEWEIDI-UHFFFAOYSA-N- Molecular formula
- C23H30ClN5
- Average molar mass
- 412 g/mol
- Monoisotopic mass
- 411.2189737
Names & identifiers
- Preferred name
- 3-[5-chloro-1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1'-yl]propan-1-amine
- IUPAC
- 3-[5-chloro-1-(5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1'-yl]propan-1-amine
Names & synonyms
SCHEMBL3727911
Database identifiers
- PubChem CID
- 68763577
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 58.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 565
Related reactions
1 records
Compound notes
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