Basic information
- Standard SMILES
CSc1nc2cc(Cl)c(Cl)cc2[nH]1- InChIKey
OBYWDNBOQUIKNW-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2N2S
- Average molar mass
- 233.12 g/mol
Names & identifiers
- Preferred name
- 5,6-dichloro-2-(methylthio)-1H-benzo[d]imidazole
- IUPAC
- 5,6-dichloro-2-methylsulfanyl-1H-benzimidazole
Names & synonyms
20076-54-45,6-dichloro-2-(methylthio)-1H-benzo[d]imidazole5,6-dichloro-2-methylsulfanyl-1H-benzimidazole5,6-dichloro-2-(methylsulfanyl)-1H-1,3-benzodiazoleMFCD006623401H-Benzimidazole, 5,6-dichloro-2-(methylthio)-5,6-Dichloro-2-[methylthio]benzimidazole5,6-DiChloro-2-(methylthio)benzimidazoleMaybridge3_005059CHEMBL67822SCHEMBL7517182HMS1445F21
Show more names
CCG-49617AKOS027461017IDI1_016446AS-67874DB-066054CS-0060093NS00016571W17341
Database identifiers
- PubChem CID
- 608104
- ChEMBL
CHEMBL67822- Nikkaji
- J506.722G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Related reactions
1 records
Compound notes
Loading…