Imidazo(1,5-a)pyridin-1(5H)-one, hexahydro-2-(3-methylphenyl)-3-thioxo-
Basic information
- CAS
60725-90-8- Standard SMILES
Cc1cccc(N2C(=O)C3CCCCN3C2=S)c1- InChIKey
ZCXUQVWCFGDELT-UHFFFAOYSA-N- Molecular formula
- C14H16N2OS
- Average molar mass
- 260.36 g/mol
- Monoisotopic mass
- 260.09833431
Names & identifiers
- Preferred name
- Imidazo(1,5-a)pyridin-1(5H)-one, hexahydro-2-(3-methylphenyl)-3-thioxo-
- IUPAC
- 2-(3-methylphenyl)-3-sulfanylidene-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-1-one
Names & synonyms
60725-90-8Imidazo(1,5-a)pyridin-1(5H)-one, hexahydro-2-(3-methylphenyl)-3-thioxo-DTXSID309761882-(3-Methylphenyl)-3-sulfanylidenehexahydroimidazo[1,5-a]pyridin-1(5H)-one
Database identifiers
- CAS
60725-90-8- PubChem CID
- 187989
- DTXSID
DTXSID30976188
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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