Basic information
- CAS
912999-94-1- Standard SMILES
COc1ccc(CN2C(=O)c3cccc(OCCCN4CCOCC4)c3C2=O)c(OC)c1- InChIKey
VWUTUZDKJLCEFP-UHFFFAOYSA-N- Molecular formula
- C24H28N2O6
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.19473662
Names & identifiers
- Preferred name
- 2-(2,4-Dimethoxy-benzyl)-4-(3-morpholin-4-yl-propoxy)-isoindole-1,3-dione
- IUPAC
- 2-[(2,4-dimethoxyphenyl)methyl]-4-(3-morpholin-4-ylpropoxy)isoindole-1,3-dione
Names & synonyms
SCHEMBL383969VWUTUZDKJLCEFP-UHFFFAOYSA-NDTXSID1011252702-(2,4-Dimethoxy-benzyl)-4-(3-morpholin-4-yl-propoxy)-isoindole-1,3-dione912999-94-12-[(2,4-Dimethoxyphenyl)methyl]-4-[3-(4-morpholinyl)propoxy]-1H-isoindole-1,3(2H)-dione2-[(2,4-Dimethoxyphenyl)methyl]-4-[3-(morpholin-4-yl)propoxy]-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
912999-94-1- PubChem CID
- 59263155
- DTXSID
DTXSID101125270
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 640
Related reactions
19 records
Compound notes
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