Basic information
- CAS
134880-98-1- Standard SMILES
FC(F)(F)c1nc(NCc2ccccc2)sc1Cl- InChIKey
VYOJLWCTZQQMKJ-UHFFFAOYSA-N- Molecular formula
- C11H8ClF3N2S
- Average molar mass
- 292.71 g/mol
- Monoisotopic mass
- 292.0048816
Names & identifiers
- Preferred name
- 5-Chloro-N-(phenylmethyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine
- IUPAC
- N-benzyl-5-chloro-4-(trifluoromethyl)-1,3-thiazol-2-amine
Names & synonyms
5-Chloro-N-(phenylmethyl)-4-(trifluoromethyl)-1,3-thiazol-2-amine134880-98-1N-benzyl-5-chloro-4-(trifluoromethyl)-1,3-thiazol-2-amineDTXSID00159042
Database identifiers
- CAS
134880-98-1- PubChem CID
- 178200
- DTXSID
DTXSID00159042
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 53.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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