2-[(2-methylphenyl)methylsulfanyl]-N-(4-propan-2-ylphenyl)acetamide
Basic information
- CAS
6170-53-2- Standard SMILES
Cc1ccccc1CSCC(=O)Nc1ccc(C(C)C)cc1- InChIKey
JWMCICFZTFREHC-UHFFFAOYSA-N- Molecular formula
- C19H23NOS
- Average molar mass
- 313.5 g/mol
- Monoisotopic mass
- 313.15003553
Names & identifiers
- Preferred name
- 2-[(2-methylphenyl)methylsulfanyl]-N-(4-propan-2-ylphenyl)acetamide
- IUPAC
- 2-[(2-methylphenyl)methylsulfanyl]-N-(4-propan-2-ylphenyl)acetamide
Names & synonyms
6170-53-2N-(4-isopropylphenyl)-2-[(2-methylbenzyl)thio]acetamideDTXSID109772792-[(2-methylphenyl)methylsulfanyl]-N-(4-propan-2-ylphenyl)acetamide2-{[(2-Methylphenyl)methyl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Database identifiers
- CAS
6170-53-2- PubChem CID
- 875299
- DTXSID
DTXSID10977279
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 336
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Compound notes
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