Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C15H19IN4S
- Molecular weight
- 414.3 g/mol
- IUPAC name
- 3-(1H-imidazol-5-yl)propyl N'-[2-(4-iodophenyl)ethyl]carbamimidothioate
- SMILES
- C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I
- InChIKey
- UBHYDQAARZKHEZ-UHFFFAOYSA-N
- XLogP
- 3.3
- Polar surface area
- 92.4 Ų
- H-bond donors
- 2
- H-bond acceptors
- 3
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Research
30 papersvia PubMed
Wikidata facts
- Mass
- 414.038
Show 4 more facts
- canonical SMILES
- C1=CC(=CC=C1CCN=C(N)SCCCC2=CN=CN2)I
- chemical formula
- C₁₅H₁₉IN₄S
- isomeric SMILES
- N/C(=N/CCC1=CC=C(I)C=C1)/SCCCC2=CN=CN2
- Commons category
- Iodophenpropit
via Wikidata · CC0