Basic information
- CAS
355391-79-6- Standard SMILES
CCCCCOC(=O)c1ccc(N2C(=O)c3ccc(C(=O)OC(CCCC)C(=O)c4ccc(-c5ccccc5)cc4)cc3C2=O)cc1- InChIKey
NWANNQYGGVDRAM-UHFFFAOYSA-N- Molecular formula
- C39H37NO7
- Average molar mass
- 631.7 g/mol
Names & identifiers
- Preferred name
- [1-Oxo-1-(4-phenylphenyl)hexan-2-yl] 1,3-dioxo-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylate
- IUPAC
- [1-oxo-1-(4-phenylphenyl)hexan-2-yl] 1,3-dioxo-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylate
- English name
- 1-([1,1'-biphenyl]-4-ylcarbonyl)pentyl 1,3-dioxo-2-{4-[(pentyloxy)carbonyl]phenyl}-5-isoindolinecarboxylate
- Molecular formula
- C39H37NO7
- Molecular weight
- 631.71358
Names & synonyms
1-([1,1'-biphenyl]-4-ylcarbonyl)pentyl 1,3-dioxo-2-{4-[(pentyloxy)carbonyl]phenyl}-5-isoindolinecarboxylate1-(biphenyl-4-yl)-1-oxohexan-2-yl 1,3-dioxo-2-{4-[(pentyloxy)carbonyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylateSTK268954AKOS003244651AKOS022066431[1-oxo-1-(4-phenylphenyl)hexan-2-yl] 1,3-dioxo-2-(4-pentoxycarbonylphenyl)isoindole-5-carboxylateST50855105AK-918/124404361-butyl-2-oxo-2-(4-phenylphenyl)ethyl 1,3-dioxo-2-[4-(pentyloxycarbonyl)phenyl ]benzo[c]azoline-5-carboxylate
Database identifiers
- CAS
355391-79-6
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 16
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,080
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
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Compound notes
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