Basic information
- CAS
47165-00-4- Standard SMILES
N=C(N)c1ccc(-c2cc3cc(C(=N)N)ccc3o2)cc1- InChIKey
JRXHEVUXNLGIOP-UHFFFAOYSA-N- Molecular formula
- C16H14N4O
- Average molar mass
- 278.31 g/mol
- Monoisotopic mass
- 278.11676108
Overview
structure given in first source
Names & identifiers
- Preferred name
- 2-(4-Amidinophenyl)-1-benzofuran-5-carboxamidine
- IUPAC
- 2-(4-carbamimidoylphenyl)-1-benzofuran-5-carboximidamide
- English name
- 2-(4-amidinophenyl)-1-benzofuran-5-carboxamidine
- Molecular weight
- 0
Names & synonyms
2-(4-Amidinophenyl)-1-benzofuran-5-carboxamidine47165-00-4Dapi-ORefChem:9093032-(4-carbamimidoylphenyl)-1-benzofuran-5-carboximidamideCHEMBL354342NSC2408935-Benzofurancarboximidamide, 2-(4-(aminoiminomethyl)phenyl)-5-Benzofurancarboximidamide, 2-[4-(aminoiminomethyl)phenyl]-2-(4-amidinophenyl)-5-benzo[b]furancarboxamidineSCHEMBL5030472DTXSID90963756
Show more names
BDBM500099602-(4-carbamimidoylphenyl)benzofuran-5-carboxamidine
Database identifiers
- CAS
47165-00-4- PubChem CID
- 147287
- DTXSID
DTXSID90963756- ChEMBL
CHEMBL354342- Nikkaji
- J277.731B
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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