1-[2-(2,6-dioxo-piperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-3-(3-methoxy-phenyl)-urea
Basic information
- Standard SMILES
COc1cccc(NC(=O)NCc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)c1- InChIKey
CBEUJSLLWJMMPP-UHFFFAOYSA-N- Molecular formula
- C22H20N4O6
- Average molar mass
- 436.4 g/mol
Names & identifiers
- Preferred name
- 1-[2-(2,6-dioxo-piperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-3-(3-methoxy-phenyl)-urea
- IUPAC
- 1-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]methyl]-3-(3-methoxyphenyl)urea
Names & synonyms
SCHEMBL1413539CBEUJSLLWJMMPP-UHFFFAOYSA-N1-[2-(2,6-dioxo-piperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-ylmethyl]-3-(3-methoxy-phenyl)-urea
Database identifiers
- PubChem CID
- 57730486
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 801
Related reactions
2 records
Compound notes
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