2-[4-[4-(Diaminomethylideneamino)phenyl]phenyl]guanidine;sulfuric acid
Basic information
- CAS
6966-25-2- Standard SMILES
NC(N)=Nc1ccc(-c2ccc(N=C(N)N)cc2)cc1.O=S(=O)(O)O- InChIKey
IYKWCEFBGQSXBK-UHFFFAOYSA-N- Molecular formula
- C14H18N6O4S
- Average molar mass
- 366.4 g/mol
- Monoisotopic mass
- 366.11102425
Names & identifiers
- Preferred name
- 2-[4-[4-(Diaminomethylideneamino)phenyl]phenyl]guanidine;sulfuric acid
- IUPAC
- 2-[4-[4-(diaminomethylideneamino)phenyl]phenyl]guanidine;sulfuric acid
Names & synonyms
NSC187586966-25-2NSC 18758NSC-18758NCGC00013245Sulfuric acid compound with N-(4'-((amino(imino)methyl)amino)[1,1'-biphenyl]-4-yl)guanidine (1:1)CHEMBL1741645DTXSID60280806NCI18758CCG-36877NCGC00096364-01Sulfuric acid--N'',N'''-[1,1'-biphenyl]-4,4'-diyldiguanidine (1/1)
Database identifiers
- CAS
6966-25-2- PubChem CID
- 227281
- DTXSID
DTXSID60280806- ChEMBL
CHEMBL1741645
Properties
Computed structural properties
- Topological polar surface area
- 212 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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