N-naphthalen-2-yl-2-pyridin-4-ylsulfanylacetamide
Basic information
- CAS
747410-06-6- Standard SMILES
O=C(CSc1ccncc1)Nc1ccc2ccccc2c1- InChIKey
KCXWIWRYZDOMKP-UHFFFAOYSA-N- Molecular formula
- C17H14N2OS
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.08268425
Names & identifiers
- Preferred name
- N-naphthalen-2-yl-2-pyridin-4-ylsulfanylacetamide
- IUPAC
- N-naphthalen-2-yl-2-pyridin-4-ylsulfanylacetamide
Names & synonyms
N-naphthalen-2-yl-2-pyridin-4-ylsulfanylacetamideMLS000772778SMR000377376CHEMBL1587368BDBM32359cid_2103808DTXSID401329079HMS2705I17AKOS034166319747410-06-6N-(2-naphthyl)-2-(4-pyridylthio)acetamideN-(2-naphthalenyl)-2-(pyridin-4-ylthio)acetamide
Show more names
N-naphthalen-2-yl-2-pyridin-4-ylsulfanyl-ethanamideZ31703619N-(Naphthalen-2-yl)-2-[(pyridin-4-yl)sulfanyl]acetamide
Database identifiers
- CAS
747410-06-6- PubChem CID
- 2103808
- DTXSID
DTXSID401329079- ChEMBL
CHEMBL1587368
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 344
Experimental & physicochemical properties
Solubility2.3 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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