Basic information
- CAS
620932-09-4- Standard SMILES
Cc1cccc2c1N(CCOc1ccccc1)C(=O)C2=O- InChIKey
APZMVIUFGITNIS-UHFFFAOYSA-N- Molecular formula
- C17H15NO3
- Average molar mass
- 281.3 g/mol
- Monoisotopic mass
- 281.10519334
Names & identifiers
- Preferred name
- 7-Methyl-1-(2-phenoxyethyl)indole-2,3-dione
- IUPAC
- 7-methyl-1-(2-phenoxyethyl)indole-2,3-dione
Names & synonyms
7-methyl-1-(2-phenoxyethyl)indole-2,3-dione620932-09-4MLS0006245187-methyl-1-(2-phenoxyethyl)indoline-2,3-dioneSMR0003234577-methyl-1-(2-phenoxyethyl)-1H-indole-2,3-dioneCHEMBL1310488BDBM47864cid_2145491DTXSID201322677HMS2709I107-methyl-1-(2-phenoxyethyl)isatin
Show more names
AKOS001145125ST50108623VU0336754-2VU0336754-4SR-01000100365SR-01000100365-1Z577287757-methyl-1-(2-phenoxyethyl)benzo[d]azolidine-2,3-dione
Database identifiers
- CAS
620932-09-4- PubChem CID
- 2145491
- DTXSID
DTXSID201322677- ChEMBL
CHEMBL1310488
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 403
Experimental & physicochemical properties
Solubility3.4 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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