N-benzyl-2-(quinolin-8-ylsulfanyl)acetamide
Basic information
- CAS
329921-37-1- Standard SMILES
O=C(CSc1cccc2cccnc12)NCc1ccccc1- InChIKey
ZKWPUPUWXISMAA-UHFFFAOYSA-N- Molecular formula
- C18H16N2OS
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.09833431
Names & identifiers
- Preferred name
- N-benzyl-2-(quinolin-8-ylsulfanyl)acetamide
- IUPAC
- N-benzyl-2-quinolin-8-ylsulfanylacetamide
Names & synonyms
329921-37-1ZINC36113N-(Phenylmethyl)-2-(8-quinolinylthio)acetamideN-Benzyl-2-[(quinolin-8-yl)sulfanyl]acetamideN-benzyl-2-(8-quinolylthio)acetamideZINC00036113N-benzyl-2-quinolin-8-ylsulfanylacetamideCambridge id 5924452TimTec1_000592Oprea1_630494DTXSID001248041HMS1535K20
Show more names
O=C(CSc1cccc2c1nccc2)NCc1ccccc1MFCD00403719STK089783AKOS000372040N-benzyl-2-(8-quinolinylthio)acetamideNBENZYL2(8QUINOLYLTHIO)ACETAMIDENCGC00161903-01ST006249
Database identifiers
- CAS
329921-37-1- PubChem CID
- 673909
- DTXSID
DTXSID001248041
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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