Basic information
- CAS
82608-09-1- Standard SMILES
COc1ccccc1N1CCN(C(C)C(=O)c2ccc3c(c2)oc(=O)n3C)CC1- InChIKey
SCBSKCDYMPWFHI-UHFFFAOYSA-N- Molecular formula
- C22H25N3O4
- Average molar mass
- 395.5 g/mol
- Monoisotopic mass
- 395.18450629
Names & identifiers
- Preferred name
- 2-Benzoxazolinone, 6-(2-(4-(o-methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl-
- IUPAC
- 6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl]-3-methyl-1,3-benzoxazol-2-one
Names & synonyms
BRN 36350656-(2-(4-(2-Methoxyphenyl)-1-piperazinyl)propionyl)-3-methylbenzoxazolinone82608-09-16-(2-(4-(o-Methoxyphenyl)-1-piperazinyl)propionyl)-3-methyl-2-benzoxazolinone2-BENZOXAZOLINONE, 6-(2-(4-(o-METHOXYPHENYL)-1-PIPERAZINYL)PROPIONYL)-3-METHYL-RefChem:256435DTXSID7010028166-{2-[4-(2-methoxyphenyl)piperazin-1-yl]propanoyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Database identifiers
- CAS
82608-09-1- PubChem CID
- 54896
- DTXSID
DTXSID701002816- Nikkaji
- J67.938K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 607
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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