Clorcinnazine dihydrochloride
Basic information
- CAS
39245-23-3- Standard SMILES
Cl.Cl.Clc1ccc(C(c2ccccc2)N2CCN(CC=Cc3ccccc3)CC2)cc1- InChIKey
YFQRGPYJACKPRU-UHFFFAOYSA-N- Molecular formula
- C26H29Cl3N2
- Average molar mass
- 475.9 g/mol
- Monoisotopic mass
- 474.139632
Names & identifiers
- Preferred name
- Clorcinnazine dihydrochloride
- IUPAC
- 1-[(4-chlorophenyl)-phenylmethyl]-4-(3-phenylprop-2-enyl)piperazine;dihydrochloride
Names & synonyms
Clorcinnazine dihydrochlorideorb2814956DTXSID70861847
Database identifiers
- CAS
39245-23-3- PubChem CID
- 170171
- DTXSID
DTXSID70861847
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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