AC1NDSOG
6-(2-fluoro-4-methoxyphenyl)-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene
Also Known As: ChemDiv1_022297|Oprea1_302324|HMS650F11|F0832-0312|1-(2-fluoro-4-methoxyphenyl)-4-((2-isopropyl-5-methylphenoxy)methyl)-5,6,7,8-tetrahydro-2a,3,4a-triazacyclopenta[cd]azulene|6-(2-fluoro-4-methoxyphenyl)-2-[(2-isopropyl-5-methylphenoxy)methyl]-1,3,4-triazatricyclo[5.4.1.0,(1)(2)]dodeca-2,5,7(12)-triene
| Molecular Formula | C27H30FN3O2 |
|---|---|
| Molecular Weight | 447.2322 g/mol |
| LogP | 6.29762 |
| Topological Polar Surface Area | 40.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.2322 |
| Monoisotopic Mass | 447.2322 |
| Heavy Atoms | 33 |
| Complexity | 1318.893 |
Chemical Identifiers
| CAS Number | 398997-47-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC2=NN3C=C(C4=C3N2CCCC4)C5=C(C=C(C=C5)OC)F |
Product Overview
AC1NDSOG (CAS 398997-47-2), with molecular formula C27H30FN3O2 and molecular weight 447.2322 g/mol. IUPAC: 6-(2-fluoro-4-methoxyphenyl)-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene.
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