Basic information
- Standard SMILES
CC(C)c1cc(C(=O)N2Cc3ccc(N4CCOCC4)cc3C2)c(OCc2ccccc2)cc1OCc1ccccc1- InChIKey
JTMBAOORTZEKEG-UHFFFAOYSA-N- Molecular formula
- C36H38N2O4
- Average molar mass
- 562.7 g/mol
Names & identifiers
- Preferred name
- (2,4-Bis-benzyloxy-5-isopropyl-phenyl)-(5-morpholin-4-yl-1,3-dihydro-isoindol-2-yl)-methanone
- IUPAC
- [2,4-bis(phenylmethoxy)-5-propan-2-ylphenyl]-(5-morpholin-4-yl-1,3-dihydroisoindol-2-yl)methanone
Names & synonyms
SCHEMBL382351JTMBAOORTZEKEG-UHFFFAOYSA-NDB-160978(2,4-bis-benzyloxy-5-isopropyl-phenyl)-(5-morpholin-4-yl-1,3-dihydro-isoindol-2-yl)-methanone[2,4-Bis(benzyloxy)-5-isopropylphenyl][5-(morpholin-4-yl)-1,3-dihydroisoindol-2-yl]methanone913000-08-5
Database identifiers
- PubChem CID
- 59263147
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 834
Related reactions
11 records
Compound notes
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