Basic information
- Standard SMILES
O=C1c2ccccc2C(=O)N1CCSc1ccncc1- InChIKey
DNMHUDJYPUPGRO-UHFFFAOYSA-N- Molecular formula
- C15H12N2O2S
- Average molar mass
- 284.3 g/mol
Names & identifiers
- Preferred name
- 4-(2-Phthalimidoethylthio)pyridine
- IUPAC
- 2-(2-pyridin-4-ylsulfanylethyl)isoindole-1,3-dione
Names & synonyms
Oprea1_166894Oprea1_214610SCHEMBL8618065DNMHUDJYPUPGRO-UHFFFAOYSA-N4-(2-phthalimidoethylthio)pyridine4- (2-phthalimidoethylthio)pyridineAKOS033299191Z1376455901
Database identifiers
- PubChem CID
- 19079256
- Nikkaji
- J1.541.324G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 358
Related reactions
13 records
Compound notes
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