Basic information
- Standard SMILES
N#Cc1c(OCc2ccccc2)nc(N)nc1-c1ccco1- InChIKey
HURCWZISPHJVIW-UHFFFAOYSA-N- Molecular formula
- C16H12N4O2
- Average molar mass
- 292.29 g/mol
Names & identifiers
- Preferred name
- 2-Amino-4-benzyloxy-6-furan-2-yl-pyrimidine-5-carbonitrile
- IUPAC
- 2-amino-4-(furan-2-yl)-6-phenylmethoxypyrimidine-5-carbonitrile
Names & synonyms
SCHEMBL5046632HURCWZISPHJVIW-UHFFFAOYSA-N2-amino-4-benzyloxy-6-furan-2-yl-pyrimidine-5-carbonitrile
Database identifiers
- PubChem CID
- 9814581
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 404
Related reactions
2 records
Compound notes
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