AC1LJRGN
(6-amino-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraen-5-yl)-(4-methoxyphenyl)methanone
Also Known As: Oprea1_829674|KS-00003RYX|(3-amino-6,7,8,9-tetrahydro-5H-cyclohepta[b]thieno[3,2-e]pyridin-2-yl)(4-methoxyphenyl)methanone|SS-0538|AM-807/14959493|(6-amino-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraen-5-yl)-(4-methoxyphenyl)methanone|5-(4-methoxybenzoyl)-4-thia-2-azatricyclo[7.5.0.0^{3,7}]tetradeca-1(9),2,5,7-tetraen-6-amine
| Molecular Formula | C20H20N2O2S |
|---|---|
| Molecular Weight | 352.12454 g/mol |
| LogP | 4.387 |
| Topological Polar Surface Area | 65.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.12454 |
| Monoisotopic Mass | 352.12454 |
| Heavy Atoms | 25 |
| Complexity | 944.47974 |
Chemical Identifiers
| CAS Number | 445385-16-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)C2=C(C3=C(S2)N=C4CCCCCC4=C3)N |
Product Overview
AC1LJRGN (CAS 445385-16-0), with molecular formula C20H20N2O2S and molecular weight 352.12454 g/mol. IUPAC: (6-amino-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraen-5-yl)-(4-methoxyphenyl)methanone.
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