Basic information
- CAS
124076-63-7- Standard SMILES
N=C(N)c1ccc(NCCCCCNc2ccc(C(=N)N)cc2)cc1- InChIKey
VSJMHEKEUIXCLJ-UHFFFAOYSA-N- Molecular formula
- C19H26N6
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.22189485
Names & identifiers
- Preferred name
- 4,4'-(1,5-Pentanediyldiimino)bis-benzenecarboximidamide
- IUPAC
- 4-[5-(4-carbamimidoylanilino)pentylamino]benzenecarboximidamide
Names & synonyms
4,4'-(1,5-Pentanediyldiimino)bis-benzenecarboximidamide124076-63-7CHEMBL492579CHEMBL22866DTXSID20154211BDBM503680984-[5-(4-carbamimidoylanilino)pentylamino]benzamidine4,4'-[Pentane-1,5-diylbis(azanediyl)]di(benzene-1-carboximidamide)4-({5-[(4-amidinophenyl)amino]pentyl}amino)benzenecarboxamidine
Database identifiers
- CAS
124076-63-7- PubChem CID
- 147804
- DTXSID
DTXSID20154211- ChEMBL
CHEMBL22866、CHEMBL492579- Nikkaji
- J292.009C
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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