Methyl-ap-237 hydrochloride
Basic information
- CAS
98608-59-4- Standard SMILES
CCCC(=O)N1CCN(C/C=C/c2ccccc2)CC1C.Cl- InChIKey
GPYVJSNBBPAWLD-RVDQCCQOSA-N- Molecular formula
- C18H27ClN2O
- Average molar mass
- 322.9 g/mol
- Monoisotopic mass
- 322.1811912
Names & identifiers
- Preferred name
- Methyl-ap-237 hydrochloride
- IUPAC
- 1-[2-methyl-4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butan-1-one;hydrochloride
Names & synonyms
98608-59-4N-Butyryl-N'-cinnamyl-2-methylpiperazine hydrochlorideMethyl-ap-237 hydrochlorideVID4TX8798UNII-VID4TX87982-Methyl-1-(1-oxobutyl)-4-(3-phenyl-2-propenyl)piperazine monohydrochloridePiperazine, 2-methyl-1-(1-oxobutyl)-4-(3-phenyl-2-propenyl)-, monohydrochloride2-METHYL-AP-237 HYDROCHLORIDEBUCINNAZINE, 2-METHYL HYDROCHLORIDE1-BUTANONE, 1-(2-METHYL-4-(3-PHENYL-2-PROPEN-1-YL)-1-PIPERAZINYL)-, HYDROCHLORIDE (1:1)RefChem:2017402-methyl AP-237 (hydrochloride)
Show more names
1-[2-methyl-4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butan-1-one;hydrochlorideSCHEMBL11005505PD0947831-[4-[(E)-cinnamyl]-2-methyl-piperazin-1-yl]butan-1-one;hydrochloride1-[2-methyl-4-(3-phenyl-2-propen-1-yl)-1-piperazinyl]-1-butanone, monohydrochloride
Database identifiers
- CAS
98608-59-4- PubChem CID
- 6447698
- UNII
- VID4TX8798
Properties
Computed structural properties
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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