Azapetine Hydrochloride
Basic information
- CAS
65-15-6- Standard SMILES
C=CCN1Cc2ccccc2-c2ccccc2C1.Cl- InChIKey
PAGNTBKVOFUKLT-UHFFFAOYSA-N- Molecular formula
- C17H18ClN
- Average molar mass
- 271.8 g/mol
- Monoisotopic mass
- 271.1127773
Overview
See also: Azapetine (has active moiety).
Names & identifiers
- Preferred name
- Azapetine Hydrochloride
- IUPAC
- 6-prop-2-enyl-5,7-dihydrobenzo[d][2]benzazepine;hydrochloride
Names & synonyms
Azapetine hydrochlorideAzapetine HCl65-15-6KN855K6HSODTXSID402153135H-Dibenz(c,e)azepine, 6,7-dihydro-6-(2-propenyl)-, hydrochloride5H-Dibenz(c,e)azepine, 6-allyl-6,7-dihydro-, hydrochlorideRefChem:115961DTXCID40137804AzapetineHydrochloride6-prop-2-enyl-5,7-dihydrobenzo[d][2]benzazepine;hydrochloride6-Allyl-6,7-dihydro-5H-dibenzo[c,e]azepine hydrochloride
Show more names
UNII-KN855K6HSOstarbld00033226,7-Dihydro-6-(2-propenyl)-5H-dibenz(c,e)azepine hydrochlorideAZAPENTINE HYDROCHLORIDEorb3237221SCHEMBL6763929Q272823446-(Prop-2-en-1-yl)-6,7-dihydro-5H-dibenzo[c,e]azepine--hydrogen chloride (1/1)
Database identifiers
- CAS
65-15-6- PubChem CID
- 120163
- DTXSID
DTXSID40215313- UNII
- KN855K6HSO
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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