AC1LS97B
1-[5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]thiophen-2-yl]-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone
Also Known As: KS-00003D2L|7M-005|1-(5-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)methyl)-2-thienyl)-2-((5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl)sulfanyl)-1-ethanone|1-(5-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl}thiophen-2-yl)-2-{[5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethan-1-one|1-[5-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methyl]thiophen-2-yl]-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone|1-(5-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]METHYL)-2-THIENYL)-2-([5-(3-PYRIDINYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL)-1-ETHANONE|1-(5-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl}-2-thienyl)-2-{[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-ethanone
| Molecular Formula | C20H12ClF3N4O2S2 |
|---|---|
| Molecular Weight | 496.00424 g/mol |
| LogP | 5.8261 |
| Topological Polar Surface Area | 81.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.00424 |
| Monoisotopic Mass | 496.00424 |
| Heavy Atoms | 32 |
| Complexity | 1245.1332 |
Chemical Identifiers
| CAS Number | 339016-53-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NN=C(O2)SCC(=O)C3=CC=C(S3)CC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
AC1LS97B (CAS 339016-53-4), with molecular formula C20H12ClF3N4O2S2 and molecular weight 496.00424 g/mol. IUPAC: 1-[5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]thiophen-2-yl]-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone.
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