Basic information
- CAS
65976-39-8- Standard SMILES
CC/C(=N/NC(N)=O)c1ccc(OCCCN2CCN(c3ccccc3)CC2)cc1.Cl.Cl- InChIKey
QQKXNQREDMEBDM-PJXKUKQXSA-N- Molecular formula
- C23H33Cl2N5O2
- Average molar mass
- 482.4 g/mol
- Monoisotopic mass
- 481.2011307
Names & identifiers
- Preferred name
- Propiophenone, 4'-(3-(4-phenyl-1-piperazinyl)propoxy)-, semicarbazone, dihydrochloride
- IUPAC
- [(Z)-1-[4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]propylideneamino]urea;dihydrochloride
Names & synonyms
Propiophenone, 4'-(3-(4-phenyl-1-piperazinyl)propoxy)-, semicarbazone, dihydrochloride65976-39-8RefChem:10970101-(p-Propionylphenoxy)-3-(N-phenylpiperazinyl)propane semicarbazone dihydrochlorideSemicarbazide, 1-(1-(4-(3-(4-phenyl-1-piperazinyl)propoxy)phenyl)propylidene)-, 2HCl
Database identifiers
- CAS
65976-39-8- PubChem CID
- 6509934
Properties
Computed structural properties
- Topological polar surface area
- 83.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 534
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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