AC1NAPX7
N-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-nitro-1,2,4-triazol-1-yl)adamantane-1-carboxamide
Also Known As: AK-968/40734079|N-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-nitro-1,2,4-triazol-1-yl)adamantane-1-carboxamide|N-[2-fluoro-5-(trifluoromethyl)phenyl]-3-{3-nitro-1H-1,2,4-triazol-1-yl}-1-adamantanecarboxamide|N-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide|N~1~-[2-FLUORO-5-(TRIFLUOROMETHYL)PHENYL]-3-(3-NITRO-1H-1,2,4-TRIAZOL-1-YL)-1-ADAMANTANECARBOXAMIDE
| Molecular Formula | C20H19F4N5O3 |
|---|---|
| Molecular Weight | 453.1424 g/mol |
| LogP | 4.2784 |
| Topological Polar Surface Area | 102.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 453.1424 |
| Monoisotopic Mass | 453.1424 |
| Heavy Atoms | 32 |
| Complexity | 1100.8951 |
Chemical Identifiers
| CAS Number | 515151-39-0 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)N4C=NC(=N4)[N+](=O)[O-])C(=O)NC5=C(C=CC(=C5)C(F)(F)F)F |
Product Overview
AC1NAPX7 (CAS 515151-39-0), with molecular formula C20H19F4N5O3 and molecular weight 453.1424 g/mol. IUPAC: N-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(3-nitro-1,2,4-triazol-1-yl)adamantane-1-carboxamide.
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