Ucb 4208
Basic information
- CAS
1769-99-9- Standard SMILES
C[NH+](C)CCCC1(C#N)c2ccccc2CCc2ccccc21.[Cl-]- InChIKey
RWOJIGUPDYXZBN-UHFFFAOYSA-N- Molecular formula
- C21H25ClN2
- Average molar mass
- 340.9 g/mol
- Monoisotopic mass
- 340.1706265
Names & identifiers
- Preferred name
- Ucb 4208
- IUPAC
- 3-(2-cyano-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propyl-dimethylazanium chloride
Names & synonyms
UCB 4208NSC 1690975H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-cyano-5-(3-dimethylaminopropyl)-, hydrochloride5-Cyano-10,11-dihydro-5-(3-dimethyl-aminopropyl)-5H-dibenzo(a,d)cycloheptene hydrochloride5H-Dibenzo(a,d)cycloheptene-5-propylamine, 10,11-dihydro-5-cyano-N,N-dimethyl-, HCl1769-99-95H-Dibenzo(a,d)cycloheptene-5-carbonitrile, 5-(3-(dimethylamino)propyl)-10,11-dihydro-, monohydrochlorideRefChem:3868245H-Dibenzo(a,d)cycloheptene-5-carbonitrile, 5-(3-(dimethylamino)propyl)-10,11-dihydro-, monohydrochloride (9CI)
Database identifiers
- CAS
1769-99-9- PubChem CID
- 15675
Properties
Computed structural properties
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 408
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Compound notes
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