1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrahydro-2-(4-(2-(1-piperidinyl)ethoxy)phenyl)-
Basic information
- CAS
61356-13-6- Standard SMILES
O=C1C2=C(CCCC2)C(=O)N1c1cccc(OCCN2CCCCC2)c1- InChIKey
QDSOMOUCMJWFFW-UHFFFAOYSA-N- Molecular formula
- C21H26N2O3
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.1943427
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrahydro-2-(4-(2-(1-piperidinyl)ethoxy)phenyl)-
- IUPAC
- 2-[3-(2-piperidin-1-ylethoxy)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione
Names & synonyms
61356-13-61H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrahydro-2-(4-(2-(1-piperidinyl)ethoxy)phenyl)-DTXSID702102704,5,6,7-Tetrahydro-2-(4-(2-(1-piperidinyl)ethoxy)phenyl)-1H-isoindole-1,3(2H)-dioneRefChem:239352DTXCID701327612-{3-[2-(piperidin-1-yl)ethoxy]phenyl}-4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
61356-13-6- PubChem CID
- 43620
- DTXSID
DTXSID70210270
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 552
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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