Acetamide, N-phenyl-N-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)-
Basic information
- CAS
140867-42-1- Standard SMILES
CC(=O)N(C1=NCCCCS1)c1ccccc1- InChIKey
YBCVABBBEWBSFN-UHFFFAOYSA-N- Molecular formula
- C13H16N2OS
- Average molar mass
- 248.35 g/mol
- Monoisotopic mass
- 248.09833431
Names & identifiers
- Preferred name
- Acetamide, N-phenyl-N-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)-
- IUPAC
- N-phenyl-N-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)acetamide
Names & synonyms
140867-42-1Acetamide, N-phenyl-N-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)-DTXSID40356159RefChem:315611DTXCID50307218N-phenyl-N-(4,5,6,7-tetrahydro-1,3-thiazepin-2-yl)acetamideHMS1672G07AKOS000601858ST50224520AG-690/09448047N-(4,5-dihydro-6H,7H-1,3-thiazepin-2-yl)-N-phenylacetamide
Database identifiers
- CAS
140867-42-1- PubChem CID
- 820117
- DTXSID
DTXSID40356159
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 298
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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