6-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
Basic information
- CAS
203803-51-4- Standard SMILES
COc1ccc(-c2cc(-c3ccco3)[nH]c(=O)c2C#N)cc1- InChIKey
ZYTOQORBYHDIQT-UHFFFAOYSA-N- Molecular formula
- C17H12N2O3
- Average molar mass
- 292.29 g/mol
- Monoisotopic mass
- 292.08479225
Names & identifiers
- Preferred name
- 6-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
- IUPAC
- 6-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile
Names & synonyms
MLS0007781126-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrileSMR0004145066-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile6-Furan-2-yl-4-(4-methoxy-phenyl)-2-oxo-1,2-dihydro-pyridine-3-carbonitrile203803-51-4cid_950140CHEMBL1577453BDBM69549DTXSID701325614HMS2771D03STK542684
Show more names
AKOS005472489ST0603596-(2-furyl)-2-keto-4-(4-methoxyphenyl)-1H-pyridine-3-carbonitrile6-(2-furyl)-4-(4-methoxyphenyl)-2-oxohydropyridine-3-carbonitrile6-(2-furanyl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile6-(furan-2-yl)-4-(4-methoxyphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile
Database identifiers
- CAS
203803-51-4- PubChem CID
- 950140
- DTXSID
DTXSID701325614- ChEMBL
CHEMBL1577453
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 562
Experimental & physicochemical properties
Solubility5.3 [ug/mL] (The mean of the results at pH 7.4)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…