Basic information
- CAS
66639-24-5- Standard SMILES
N=C(N)c1ccc2nc(CCCc3nc4ccc(C(=N)N)cc4[nH]3)[nH]c2c1- InChIKey
JSWDSBAWSDFTEK-UHFFFAOYSA-N- Molecular formula
- C19H20N8
- Average molar mass
- 360.4 g/mol
- Monoisotopic mass
- 360.18109267
Names & identifiers
- Preferred name
- 1H-Benzimidazole-5-carboximidamide, 2,2'-(1,3-propanediyl)bis-
- IUPAC
- 2-[3-(6-carbamimidoyl-1H-benzimidazol-2-yl)propyl]-3H-benzimidazole-5-carboximidamide
Names & synonyms
66639-24-5CHEMBL1456561H-Benzimidazole-5-carboximidamide, 2,2'-(1,3-propanediyl)bis-2,2'-(Propane-1,3-diyl)bis(1H-benzo[d]imidazole-5-carboximidamide)SCHEMBL548407DTXSID702167922,2'-(1,3-Propanediyl)bis-1H-benzimidazole-5-carboximidamideBDBM50010019SY3668291,3-Bis(5-amidino-2-benzimidazolyl)propane tetrahydrochloride2,2'-(Propane-1,3-diyl)di(1H-1,3-benzimidazole-6-carboximidamide)2-[3-(5-carbamimidoyl-1H-benzimidazol-2-yl)propyl]-1H-benzimidazole-5-carboxamidine
Show more names
2,2 inverted exclamation mark -(Propane-1,3-diyl)bis(1H-benzo[d]imidazole-5-carboximidamide)
Database identifiers
- CAS
66639-24-5- PubChem CID
- 149378
- DTXSID
DTXSID70216792- ChEMBL
CHEMBL145656- Nikkaji
- J551.870I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 157 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 518
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…