1H-Benzimidazole-5-carboximidamide, N-cyclopentyl-2-(5-(4-((cyclopentylamino)iminomethyl)phenyl)-2-furanyl)-
Basic information
- CAS
216308-25-7- Standard SMILES
NC(=NC1CCCC1)c1ccc(-c2ccc(-c3nc4ccc(C(N)=NC5CCCC5)cc4[nH]3)o2)cc1- InChIKey
MDWLEANZLZWRKW-UHFFFAOYSA-N- Molecular formula
- C29H32N6O
- Average molar mass
- 480.6 g/mol
- Monoisotopic mass
- 480.26375967
Names & identifiers
- Preferred name
- 1H-Benzimidazole-5-carboximidamide, N-cyclopentyl-2-(5-(4-((cyclopentylamino)iminomethyl)phenyl)-2-furanyl)-
- IUPAC
- N'-cyclopentyl-2-[5-[4-(N'-cyclopentylcarbamimidoyl)phenyl]furan-2-yl]-3H-benzimidazole-5-carboximidamide
Names & synonyms
216308-25-71H-Benzimidazole-5-carboximidamide, N-cyclopentyl-2-(5-(4-((cyclopentylamino)iminomethyl)phenyl)-2-furanyl)-2-(4-(N-Cyclopentylamidino)phenyl)-5-(2-(5-(N-cy-clopentylamidino)benzimidazoyl))furan2-[4-(N-Cyclopentylamidino)phenyl]-5-[2-(5-(N-cy-clopentylamidino)benzimidazoyl)]furan1H-Benzimidazole-5-carboximidamide, N-cyclopentyl-2-[5-[4-[(cyclopentylamino)iminomethyl]phenyl]-2-furanyl]-CHEMBL127078DTXSID70176024N'-Cyclopentyl-2-{5-[4-(N'-cyclopentylcarbamimidoyl)phenyl]furan-2-yl}-1H-1,3-benzimidazole-6-carboximidamideN-cyclopentyl-2-[5-[4-(N-cyclopentylcarbamimidoyl)phenyl]-2-furyl]-1H-benzimidazole-5-carboxamidineN-cyclopentyl-2-[5-[4-(N-cyclopentylcarbamimidoyl)phenyl]-2-furyl]-3H-benzimidazole-5-carboxamidine
Database identifiers
- CAS
216308-25-7- PubChem CID
- 460073
- DTXSID
DTXSID70176024- ChEMBL
CHEMBL127078- Nikkaji
- J1.016.178I
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 796
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…