Basic information
- Standard SMILES
O=C(c1ccc[nH]1)c1cccn1N1C(=O)c2ccccc2C1=O- InChIKey
PLRINQQPCJYKSP-UHFFFAOYSA-N- Molecular formula
- C17H11N3O3
- Average molar mass
- 305.29 g/mol
Names & identifiers
- Preferred name
- 2-[2-(1H-Pyrrol-2-ylcarbonyl)-1H-pyrrol-1-yl]-1H-isoindole-1,3(2H)dione
- IUPAC
- 2-[2-(1H-pyrrole-2-carbonyl)pyrrol-1-yl]isoindole-1,3-dione
Names & synonyms
SCHEMBL8877807PLRINQQPCJYKSP-UHFFFAOYSA-N2-[2-(1H-Pyrrol-2-ylcarbonyl)-1H-pyrrol-1-yl]-1H-isoindole-1,3(2H)dione
Database identifiers
- PubChem CID
- 19973178
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 511
Related reactions
6 records
Compound notes
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