Pyrimidine, 2-(4-(2-(3,4-(methylenedioxy)phenoxy)ethyl)-1-piperazinyl)-
Basic information
- CAS
19180-28-0- Standard SMILES
c1cnc(N2CCN(CCOc3ccc4c(c3)OCO4)CC2)nc1- InChIKey
NIYOOWYNPRXXAP-UHFFFAOYSA-N- Molecular formula
- C17H20N4O3
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.15354051
Names & identifiers
- Preferred name
- Pyrimidine, 2-(4-(2-(3,4-(methylenedioxy)phenoxy)ethyl)-1-piperazinyl)-
- IUPAC
- 2-[4-[2-(1,3-benzodioxol-5-yloxy)ethyl]piperazin-1-yl]pyrimidine
Names & synonyms
Pyrimidine, 2-(4-(2-(3,4-(methylenedioxy)phenoxy)ethyl)-1-piperazinyl)-19180-28-0BRN 30114142-(4-(2-(3,4-(Methylenedioxy)phenoxy)ethyl)-1-piperazinyl)pyrimidineSCHEMBL5425425DTXSID201727132-(4-{2-[(2H-1,3-Benzodioxol-5-yl)oxy]ethyl}piperazin-1-yl)pyrimidine
Database identifiers
- CAS
19180-28-0- PubChem CID
- 209073
- DTXSID
DTXSID20172713- Nikkaji
- J86.939B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 60 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 386
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Compound notes
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