Basic information
- CAS
27125-10-6- Standard SMILES
Cl.Cl.O=C(CN1CCN(CC2CN(c3ccccc3)C(=O)O2)CC1)N1CCCC1- InChIKey
FSITVNDFFRKHAB-UHFFFAOYSA-N- Molecular formula
- C20H30Cl2N4O3
- Average molar mass
- 445.4 g/mol
- Monoisotopic mass
- 444.1694962
Names & identifiers
- Preferred name
- Pyrrolidine, 1-((4-(2-oxo-3-phenyl-5-oxazolidinyl)methyl)-1-piperazinyl)acetyl)-, dihydrochloride
- IUPAC
- 5-[[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]-3-phenyl-1,3-oxazolidin-2-one;dihydrochloride
Names & synonyms
27125-10-6Pyrrolidine, 1-((4-(2-oxo-3-phenyl-5-oxazolidinyl)methyl)-1-piperazinyl)acetyl)-, dihydrochlorideRefChem:377902DTXSID009498895-({4-[2-Oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)-3-phenyl-1,3-oxazolidin-2-one--hydrogen chloride (1/2)
Database identifiers
- CAS
27125-10-6- PubChem CID
- 213834
- DTXSID
DTXSID00949889
Properties
Computed structural properties
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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