2-(Morpholin-4-yl)-2-thioxo-1-(2,4,6-trimethylphenyl)ethanone
Basic information
- CAS
37167-44-5- Standard SMILES
Cc1cc(C)c(C(=O)C(=S)N2CCOCC2)c(C)c1- InChIKey
QNENBCPEEGBSEN-UHFFFAOYSA-N- Molecular formula
- C15H19NO2S
- Average molar mass
- 277.4 g/mol
- Monoisotopic mass
- 277.11365002
Names & identifiers
- Preferred name
- 2-(Morpholin-4-yl)-2-thioxo-1-(2,4,6-trimethylphenyl)ethanone
- IUPAC
- 2-morpholin-4-yl-2-sulfanylidene-1-(2,4,6-trimethylphenyl)ethanone
Names & synonyms
37167-44-52-(morpholin-4-yl)-2-thioxo-1-(2,4,6-trimethylphenyl)ethanoneNSC148909DTXSID20302119NSC-1489092-(Morpholin-4-yl)-2-sulfanylidene-1-(2,4,6-trimethylphenyl)ethan-1-one
Database identifiers
- CAS
37167-44-5- PubChem CID
- 288174
- DTXSID
DTXSID20302119
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
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Compound notes
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