1H-Indole-4,6-dicarboximidamide, 2-phenyl-
Basic information
- CAS
75980-76-6- Standard SMILES
N=C(N)c1cc(C(=N)N)c2cc(-c3ccccc3)[nH]c2c1- InChIKey
BUOYTFVLNZIELF-UHFFFAOYSA-N- Molecular formula
- C16H15N5
- Average molar mass
- 277.32 g/mol
- Monoisotopic mass
- 277.1327455
Names & identifiers
- Preferred name
- 1H-Indole-4,6-dicarboximidamide, 2-phenyl-
- IUPAC
- 2-phenyl-1H-indole-4,6-dicarboximidamide
Names & synonyms
1H-Indole-4,6-dicarboximidamide, 2-phenyl-75980-76-6DTXSID60226885RefChem:239144DTXCID901493762-phenyl-1H-indole-4,6-dicarboximidamideSCHEMBL333474CHEMBL517506SCHEMBL29354667
Database identifiers
- CAS
75980-76-6- PubChem CID
- 156646
- DTXSID
DTXSID60226885- ChEMBL
CHEMBL517506- Nikkaji
- J1.165.069D
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 415
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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