Spiro(piperidine-4,1'-(1H)pyrido(3,4-b)indole), 2',3',4',9'-tetrahydro-((4-(3-chlorophenyl)-1-piperazinyl)acetyl)-1-(phenylmethyl)-
Basic information
- CAS
130889-44-0- Standard SMILES
O=C(CN1CCN(c2cccc(Cl)c2)CC1)N1CCc2c([nH]c3ccccc23)C12CCN(Cc1ccccc1)CC2- InChIKey
HLYQYNMKLZYEPD-UHFFFAOYSA-N- Molecular formula
- C34H38ClN5O
- Average molar mass
- 568.1 g/mol
- Monoisotopic mass
- 567.2764885
Names & identifiers
- Preferred name
- Spiro(piperidine-4,1'-(1H)pyrido(3,4-b)indole), 2',3',4',9'-tetrahydro-((4-(3-chlorophenyl)-1-piperazinyl)acetyl)-1-(phenylmethyl)-
- IUPAC
- 1-(1'-benzylspiro[4,9-dihydro-3H-pyrido[3,4-b]indole-1,4'-piperidine]-2-yl)-2-[4-(3-chlorophenyl)piperazin-1-yl]ethanone
Names & synonyms
130889-44-0Spiro(piperidine-4,1'-(1H)pyrido(3,4-b)indole), 2',3',4',9'-tetrahydro-((4-(3-chlorophenyl)-1-piperazinyl)acetyl)-1-(phenylmethyl)-DTXSID60156774RefChem:381199DTXCID00792651-(1-Benzyl-4',9'-dihydrospiro[piperidine-4,1'-pyrido[3,4-b]indol]-2'(3'H)-yl)-2-[4-(3-chlorophenyl)piperazin-1-yl]ethan-1-one
Database identifiers
- CAS
130889-44-0- PubChem CID
- 3076352
- DTXSID
DTXSID60156774
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 880
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Compound notes
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