5-(2-(5,6-Dichloro-1-(2-(diethylamino)ethyl)-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)ethylidene)-3-ethyl-2-thioxo-4-thiazolidinone
Basic information
- CAS
28543-87-5- Standard SMILES
CCN(CC)CCN1C(=CC=C2SC(=S)N(CC)C2=O)N(CC)c2cc(Cl)c(Cl)cc21- InChIKey
BXMQENLBAUPBFK-UHFFFAOYSA-N- Molecular formula
- C22H28Cl2N4OS2
- Average molar mass
- 499.5 g/mol
- Monoisotopic mass
- 498.1081593
Names & identifiers
- Preferred name
- 5-(2-(5,6-Dichloro-1-(2-(diethylamino)ethyl)-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)ethylidene)-3-ethyl-2-thioxo-4-thiazolidinone
- IUPAC
- 5-[2-[5,6-dichloro-1-[2-(diethylamino)ethyl]-3-ethylbenzimidazol-2-ylidene]ethylidene]-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Names & synonyms
28543-87-55-(2-(5,6-Dichloro-1-(2-(diethylamino)ethyl)-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)ethylidene)-3-ethyl-2-thioxo-4-thiazolidinone5-[2-[5,6-Dichloro-1-[2-(diethylamino)ethyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]ethylidene]-3-ethyl-2-thioxo-4-thiazolidinoneRefChem:2993634-Thiazolidinone, 5-[[5,6-dichloro-1-[2-(diethylamino)ethyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]ethylidene]-3-ethyl-2-thioxo-DTXSID60885436BXMQENLBAUPBFK-UHFFFAOYSA-N4-Thiazolidinone, 5-[2-[5,6-dichloro-1-[2-(diethylamino)ethyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]ethylidene]-3-ethyl-2-thioxo-NS000478725-(2-{5,6-Dichloro-1-[2-(diethylamino)ethyl]-3-ethyl-1,3-dihydro-2H-1,3-benzimidazol-2-ylidene}ethylidene)-3-ethyl-2-sulfanylidene-1,3-thiazolidin-4-one
Database identifiers
- CAS
28543-87-5- PubChem CID
- 119978
- DTXSID
DTXSID60885436- EC Number
- 249-075-3
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 87.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 743
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Chemistry & industry
Uses & manufacturing
General Manufacturing Information4-Thiazolidinone, 5-[2-[5,6-dichloro-1-[2-(diethylamino)ethyl]-3-ethyl-1,3-dihydro-2H-benzimidazol-2-ylidene]ethylidene]-3-ethyl-2-thioxo-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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