Basic information
- CAS
1265965-24-9- Standard SMILES
C/C(=C1/C(=O)Nc2ccc(CO)cc21)c1cc(CN2CCOCC2)c[nH]1- InChIKey
GCMNYFBRZIJFQA-UYRXBGFRSA-N- Molecular formula
- C20H23N3O3
- Average molar mass
- 353.4 g/mol
- Monoisotopic mass
- 353.1739416
Names & identifiers
- Preferred name
- 2H-Indol-2-one, 1,3-dihydro-5-(hydroxymethyl)-3-[1-[4-(4-morpholinylmethyl)-1H-pyrrol-2-yl]ethylidene]-, (3Z)-
- IUPAC
- (3Z)-5-(hydroxymethyl)-3-[1-[4-(morpholin-4-ylmethyl)-1H-pyrrol-2-yl]ethylidene]-1H-indol-2-one
Names & synonyms
DTXSID9011083331265965-24-92H-Indol-2-one, 1,3-dihydro-5-(hydroxymethyl)-3-[1-[4-(4-morpholinylmethyl)-1H-pyrrol-2-yl]ethylidene]-, (3Z)-
Database identifiers
- CAS
1265965-24-9- PubChem CID
- 165367397
- DTXSID
DTXSID901108333
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 559
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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