Basic information
- CAS
66639-43-8- Standard SMILES
N=C(N)c1ccc(-c2ccc(-c3ccc(C(=N)N)cc3)[nH]2)cc1- InChIKey
NLYYZWPKTIYUOI-UHFFFAOYSA-N- Molecular formula
- C18H17N5
- Average molar mass
- 303.4 g/mol
- Monoisotopic mass
- 303.14839556
Names & identifiers
- Preferred name
- Benzenecarboximidamide, 4,4'-(1H-pyrrole-2,5-diyl)bis-
- IUPAC
- 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzenecarboximidamide
Names & synonyms
Benzenecarboximidamide, 4,4'-(1H-pyrrole-2,5-diyl)bis-CHEMBL16448966639-43-8BRN 04269384,4'-(1H-Pyrrole-2,5-diyl)bis(benzenecarboximidamide)SCHEMBL6485933DTXSID30216793BDBM500099692,5-Bis(4-quanylphenyl)-pyrrole dihydrochloride4,4'-(1H-Pyrrole-2,5-diyl)di(benzene-1-carboximidamide)4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzamidine
Database identifiers
- CAS
66639-43-8- PubChem CID
- 3000768
- DTXSID
DTXSID30216793- ChEMBL
CHEMBL164489
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 393
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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