2-Benzoxazolinone, 3-methyl-6-(3-(4-methyl-1-piperazinyl)propionyl)-, dihydrochloride
Basic information
- CAS
59384-77-9- Standard SMILES
CN1CCN(CCC(=O)c2ccc3c(c2)oc(=O)n3C)CC1.Cl.Cl- InChIKey
BVMARGKVBPFZCX-UHFFFAOYSA-N- Molecular formula
- C16H23Cl2N3O3
- Average molar mass
- 376.3 g/mol
- Monoisotopic mass
- 375.111647
Names & identifiers
- Preferred name
- 2-Benzoxazolinone, 3-methyl-6-(3-(4-methyl-1-piperazinyl)propionyl)-, dihydrochloride
- IUPAC
- 3-methyl-6-[3-(4-methylpiperazin-1-yl)propanoyl]-1,3-benzoxazol-2-one;dihydrochloride
Names & synonyms
2-Benzoxazolinone, 3-methyl-6-(3-(4-methyl-1-piperazinyl)propionyl)-, dihydrochloride59384-77-9DTXSID802081083-Methyl-6-(3-(4-methyl-1-piperazinyl)propionyl)-2-benzoxazolinone dihydrochlorideRefChem:256423DTXCID601305993-Methyl-6-[3-(4-methylpiperazin-1-yl)propanoyl]-1,3-benzoxazol-2(3H)-one--hydrogen chloride (1/2)
Database identifiers
- CAS
59384-77-9- PubChem CID
- 43024
- DTXSID
DTXSID80208108
Properties
Computed structural properties
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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