AC1LSA5Q
ethyl 4-[2-chloro-5-(trifluoromethyl)anilino]-2-methylsulfanylpyrimidine-5-carboxylate
Also Known As: Bionet1_003141|HMS577J03|KS-00003DCZ|7N-505S|ethyl 4-[2-chloro-5-(trifluoromethyl)anilino]-2-(methylsulfanyl)-5-pyrimidinecarboxylate|ethyl 4-[2-chloro-5-(trifluoromethyl)anilino]-2-methylsulfanylpyrimidine-5-carboxylate|ethyl 4-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-(methylsulfanyl)pyrimidine-5-carboxylate|Ethyl 4-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-(methylthio)-5-pyrimidinecarboxylate|Ethyl 4-[2-chloro-5-(trifluoromethyl)anilino]-2-(methylsulfanyl)pyrimidine-5-carboxylate|ethyl4-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-(methylsulfanyl)pyrimidine-5-carboxylate
| Molecular Formula | C15H13ClF3N3O2S |
|---|---|
| Molecular Weight | 391.0369 g/mol |
| LogP | 4.791 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.0369 |
| Monoisotopic Mass | 391.0369 |
| Heavy Atoms | 25 |
| Complexity | 787.1023 |
Chemical Identifiers
| CAS Number | 339019-46-4 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1NC2=C(C=CC(=C2)C(F)(F)F)Cl)SC |
Product Overview
AC1LSA5Q (CAS 339019-46-4), with molecular formula C15H13ClF3N3O2S and molecular weight 391.0369 g/mol. IUPAC: ethyl 4-[2-chloro-5-(trifluoromethyl)anilino]-2-methylsulfanylpyrimidine-5-carboxylate.
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