3-Benzothiazol-2-yl-3,5-dichloro-1,3-dihydroindol-2-one
Basic information
- Standard SMILES
O=C1Nc2ccc(Cl)cc2C1(Cl)c1nc2ccccc2s1- InChIKey
CEAYBLAMOZWFDB-UHFFFAOYSA-N- Molecular formula
- C15H8Cl2N2OS
- Average molar mass
- 335.2 g/mol
- Monoisotopic mass
- 333.9734394
Names & identifiers
- Preferred name
- 3-Benzothiazol-2-yl-3,5-dichloro-1,3-dihydroindol-2-one
- IUPAC
- 3-(1,3-benzothiazol-2-yl)-3,5-dichloro-1H-indol-2-one
Names & synonyms
SCHEMBL1465258CEAYBLAMOZWFDB-UHFFFAOYSA-N3-Benzothiazol-2-yl-3,5-dichloro-1,3-dihydroindol-2-one
Database identifiers
- PubChem CID
- 57517751
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 451
Related reactions
6 records
Compound notes
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