Basic information
- Standard SMILES
Cc1cccnc1COc1nc(N)nc(-c2ccc(Cl)o2)c1C#N- InChIKey
BZGJIIQUOLMETK-UHFFFAOYSA-N- Molecular formula
- C16H12ClN5O2
- Average molar mass
- 341.75 g/mol
Names & identifiers
- Preferred name
- 2-Amino-4-(5-chloro-furan-2-yl)-6-(3-methyl-pyridin-2-yl-methoxy)-pyrimidine-5-carbonitrile
- IUPAC
- 2-amino-4-(5-chlorofuran-2-yl)-6-[(3-methyl-2-pyridinyl)methoxy]pyrimidine-5-carbonitrile
Names & synonyms
SCHEMBL5131348BZGJIIQUOLMETK-UHFFFAOYSA-N2-Amino-4-(5-chloro-furan-2-yl)-6-(3-methyl-pyridin-2-yl-methoxy)-pyrimidine-5-carbonitrile
Database identifiers
- PubChem CID
- 18507635
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 473
Related reactions
2 records
Compound notes
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