(2E)-2-[[2-(naphthalen-1-ylmethoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Basic information
- CAS
6095-55-2- Standard SMILES
O=c1/c(=C\c2ccccc2OCc2cccc3ccccc23)sc2nc3ccccc3n12- InChIKey
UDKRDUSEZAPGNP-PCLIKHOPSA-N- Molecular formula
- C27H18N2O2S
- Average molar mass
- 434.5 g/mol
- Monoisotopic mass
- 434.10889899
Names & identifiers
- Preferred name
- (2E)-2-[[2-(naphthalen-1-ylmethoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
- IUPAC
- (2E)-2-[[2-(naphthalen-1-ylmethoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Names & synonyms
6095-55-22-[2-(1-naphthylmethoxy)benzylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-oneBAS 13120306DTXSID50367458STL416323AKOS000508641(2E)-2-[2-(naphthalen-1-ylmethoxy)benzylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one(2E)-2-[[2-(naphthalen-1-ylmethoxy)phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-oneBIM-0045540.P001(2E)-2-({2-[(Naphthalen-1-yl)methoxy]phenyl}methylidene)[1,3]thiazolo[3,2-a][1,3]benzimidazol-3(2H)-one
Database identifiers
- CAS
6095-55-2- PubChem CID
- 2268142
- DTXSID
DTXSID50367458
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 726
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Compound notes
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