Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane), 6,11-dihydro-4'-(4-(2,3-dihydroxypropyl)piperazinyl)methyl-, dimaleate
Basic information
- CAS
39890-22-7- Standard SMILES
O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O.OCC(O)CN1CCN(CC2COC3(O2)c2ccccc2COc2ccccc23)CC1- InChIKey
GCKUUXXLVPWDPG-SPIKMXEPSA-N- Molecular formula
- C32H38N2O13
- Average molar mass
- 658.6 g/mol
- Monoisotopic mass
- 658.23738927
Names & identifiers
- Preferred name
- Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane), 6,11-dihydro-4'-(4-(2,3-dihydroxypropyl)piperazinyl)methyl-, dimaleate
- IUPAC
- bis((Z)-but-2-enedioic acid);3-[4-(spiro[1,3-dioxolane-2,11'-6H-benzo[c][1]benzoxepine]-4-ylmethyl)piperazin-1-yl]propane-1,2-diol
Names & synonyms
39890-22-7Spiro(dibenz(b,e)oxepin-11,2'-(1',3')dioxolane), 6,11-dihydro-4'-(4-(2,3-dihydroxypropyl)piperazinyl)methyl-, dimaleateRefChem:1098978
Database identifiers
- CAS
39890-22-7- PubChem CID
- 6445686
Properties
Computed structural properties
- Topological polar surface area
- 224 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 9
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 705
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…