6-(2-Hydroxyethyl)-5H-indeno[1,2-c]isoquinoline-5,11(6H)-dione
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Basic information
- CAS
81721-79-1- Standard SMILES
O=C1c2ccccc2-c2c1c1ccccc1c(=O)n2CCO- InChIKey
UHXGJXGJNJTBRV-UHFFFAOYSA-N- Molecular formula
- C18H13NO3
- Average molar mass
- 291.3 g/mol
- Monoisotopic mass
- 291.08954328
Names & identifiers
- Preferred name
- 6-(2-Hydroxyethyl)-5H-indeno[1,2-c]isoquinoline-5,11(6H)-dione
- IUPAC
- 6-(2-hydroxyethyl)indeno[1,2-c]isoquinoline-5,11-dione
Names & synonyms
6-(2-Hydroxyethyl)-5H-indeno[1,2-c]isoquinoline-5,11(6H)-dione81721-79-1NSC339705NSC 3397056-(2-Hydroxyethyl)-5H-indeno(1,2-c)isoquinoline-5,11(6H)-dioneMLS0027018326-(2-hydroxyethyl)indeno[1,2-c]isoquinoline-5,11-dioneCHEMBL123218NSC-3397055GFP73J6XLSCHEMBL16312042DTXSID40231295
Show more names
UHXGJXGJNJTBRV-UHFFFAOYSA-NBDBM50388593STL5239796-(2-HYDROXYETHYL)-5H,6H,11H-INDENO[1,2-C]ISOQUINOLINE-5,11-DIONEAKOS030487573NCI60_003019SMR001565425DS-005788
Database identifiers
- CAS
81721-79-1- PubChem CID
- 334474
- DTXSID
DTXSID40231295- ChEMBL
CHEMBL123218- UNII
- 5GFP73J6XL
- Nikkaji
- J1.431.124F
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 538
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Related reactions
3 records
Compound notes
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