Basic information
- CAS
130919-40-3- Standard SMILES
Cc1cc(=O)c2c(OCC(O)CNC(C)C)c3ccoc3c(OC(C)C(N)=O)c2o1- InChIKey
IKQDBMDVVAYHMJ-UHFFFAOYSA-N- Molecular formula
- C21H26N2O7
- Average molar mass
- 418.4 g/mol
- Monoisotopic mass
- 418.17400117
Names & identifiers
- Preferred name
- Propanamide, 2-((4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-7-methyl-5-oxo-5H-furo(3,2-g)(1)benzopyran-9-yl)oxy)-
- IUPAC
- 2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-7-methyl-5-oxofuro[3,2-g]chromen-9-yl]oxypropanamide
Names & synonyms
130919-40-3Propanamide, 2-((4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-7-methyl-5-oxo-5H-furo(3,2-g)(1)benzopyran-9-yl)oxy)-RefChem:374004DTXSID509269682-[(4-{2-Hydroxy-3-[(propan-2-yl)amino]propoxy}-7-methyl-5-oxo-5H-furo[3,2-g][1]benzopyran-9-yl)oxy]propanimidic acid
Database identifiers
- CAS
130919-40-3- PubChem CID
- 3076367
- DTXSID
DTXSID50926968
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 668
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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