AC1LSTIR
2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-6-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Also Known As: KS-0000346Z|2L-011|2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-6-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine|2-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)-6-(4-methoxyphenyl)(1,2,4)triazolo[1,5-a]pyrimidin-7-amine|2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine|2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-6-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
| Molecular Formula | C18H12ClF3N6OS |
|---|---|
| Molecular Weight | 452.0434 g/mol |
| LogP | 4.6005 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.0434 |
| Monoisotopic Mass | 452.0434 |
| Heavy Atoms | 30 |
| Complexity | 1229.2946 |
Chemical Identifiers
| CAS Number | 338775-12-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(N3C(=NC(=N3)SC4=C(C=C(C=N4)C(F)(F)F)Cl)N=C2)N |
Product Overview
AC1LSTIR (CAS 338775-12-5), with molecular formula C18H12ClF3N6OS and molecular weight 452.0434 g/mol. IUPAC: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-6-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
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