1H,3H-Thiazolo(3,4-a)benzimidazole, 3-methyl-1-phenyl-, (1R,3R)-rel-
Basic information
- CAS
217321-87-4- Standard SMILES
C[C@H]1S[C@H](c2ccccc2)n2c1nc1ccccc12- InChIKey
VASRVNJXKGXTDI-BDJLRTHQSA-N- Molecular formula
- C16H14N2S
- Average molar mass
- 266.4 g/mol
- Monoisotopic mass
- 266.08776963
Names & identifiers
- Preferred name
- 1H,3H-Thiazolo(3,4-a)benzimidazole, 3-methyl-1-phenyl-, (1R,3R)-rel-
- IUPAC
- (1R,3R)-3-methyl-1-phenyl-1,3-dihydro-[1,3]thiazolo[3,4-a]benzimidazole
Names & synonyms
217321-87-41H,3H-Thiazolo(3,4-a)benzimidazole, 3-methyl-1-phenyl-, (1R,3R)-rel-trans-3-Methyl-1-phenyl-1H,3H-thiazolo(3,4-a)benzimidazoletrans-3-Methyl-1-phenyl-1H,3H-thiazolo[3,4-a]benzimidazole1H,3H-Thiazolo[3,4-a]benzimidazole, 3-methyl-1-phenyl-, (1R,3R)-rel-DTXSID10176124(1R,3R)-3-methyl-1-phenyl-1,3-dihydrothiazolo[3,4-a]benzimidazole(1R,3R)-3-Methyl-1-phenyl-1H,3H-[1,3]thiazolo[3,4-a][1,3]benzimidazole
Database identifiers
- CAS
217321-87-4- PubChem CID
- 469795
- DTXSID
DTXSID10176124
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
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Compound notes
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