5H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-(2-(4-methylpiperazinyl)ethyl)-
Basic information
- CAS
67196-63-8- Standard SMILES
CN1CCN(CCC2c3ccccc3CCc3ccccc32)CC1- InChIKey
KWOKDBYPPWUJIP-UHFFFAOYSA-N- Molecular formula
- C22H28N2
- Average molar mass
- 320.5 g/mol
- Monoisotopic mass
- 320.2252489
Names & identifiers
- Preferred name
- 5H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-(2-(4-methylpiperazinyl)ethyl)-
- IUPAC
- 1-methyl-4-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)ethyl]piperazine
- English name
- 10,11-Dihydro-5-[2-(4-methylpiperazino)ethyl]-5H-dibenzo[a,d]cycloheptene
- Molecular formula
- C22H28N2
- Molecular weight
- 320.47
Names & synonyms
BRN 06233345H-DIBENZO(a,d)CYCLOHEPTENE, 10,11-DIHYDRO-5-(2-(4-METHYLPIPERAZINYL)ETHYL)-67196-63-8DTXSID402174735-23-01-00250 (Beilstein Handbook Reference)10,11-Dihydro-5-(2-(4-methylpiperazinyl)ethyl)-5H-dibenzo(a,d)cyclohepteneRefChem:305550DTXCID40139964AM-814/410916181-[2-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yl)ethyl]-4-methylpiperazine1-[2-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)ethyl]-4-methylpiperazine10,11-Dihydro-5-[2-(4-methylpiperazino)ethyl]-5H-dibenzo[a,d]cycloheptene
Show more names
Piperazine, 1-[2-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)ethyl]-4-methyl-
Database identifiers
- CAS
67196-63-8- PubChem CID
- 49555
- DTXSID
DTXSID40217473- Nikkaji
- J72.815B
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 363
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Compound notes
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