Basic information
- CAS
519049-71-9- Standard SMILES
O=C(NCCO)C(=O)c1c(-c2ccccc2)cc2ccccn12- InChIKey
UKZQBZZYOLHDRO-UHFFFAOYSA-N- Molecular formula
- C18H16N2O3
- Average molar mass
- 308.3 g/mol
- Monoisotopic mass
- 308.11609238
Names & identifiers
- Preferred name
- N-(2-hydroxyethyl)-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
- IUPAC
- N-(2-hydroxyethyl)-2-oxo-2-(2-phenylindolizin-3-yl)acetamide
Names & synonyms
N-(2-hydroxyethyl)-2-oxo-2-(2-phenylindolizin-3-yl)acetamide519049-71-9N-(2-hydroxyethyl)-2-oxo-2-(2-phenyl-3-indolizinyl)acetamideMLS001006205SCHEMBL1644187CHEMBL1577761UKZQBZZYOLHDRO-UHFFFAOYSA-NDTXSID301333524HMS2720P15STK728831AKOS001037050SMR000349242
Show more names
Z568315233-Indolizineacetamide, N-(2-hydroxyethyl)-.alpha.-oxo-2-phenyl-
Database identifiers
- CAS
519049-71-9- PubChem CID
- 2348895
- DTXSID
DTXSID301333524- ChEMBL
CHEMBL1577761
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 434
Experimental & physicochemical properties
Solubility38.2 [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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