Basic information
- CAS
1340191-32-3- Standard SMILES
CCNC(=O)CSc1cc(N)cc(F)c1- InChIKey
KKCPDYAHJLIHRJ-UHFFFAOYSA-N- Molecular formula
- C10H13FN2OS
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.07326238
Names & identifiers
- Preferred name
- 2-[(3-Amino-5-fluorophenyl)sulfanyl]-N-ethylacetamide
- IUPAC
- 2-(3-amino-5-fluorophenyl)sulfanyl-N-ethylacetamide
Names & synonyms
DTXSID301219871AKOS0136060102-[(3-Amino-5-fluorophenyl)sulfanyl]-N-ethylacetamideAcetamide, 2-[(3-amino-5-fluorophenyl)thio]-N-ethyl-1340191-32-3
Database identifiers
- CAS
1340191-32-3- PubChem CID
- 64284366
- DTXSID
DTXSID301219871
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 80.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…