AC1LXYQ9
5-[2-(diethylamino)ethylamino]-4-(furan-2-ylmethyl)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one
Also Known As: AO-022/43453348|2-((2-(diethylamino)ethyl)amino)-3-(furan-2-ylmethyl)-6,7,8,9-tetrahydro-3H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one|2-{[2-(diethylamino)ethyl]amino}-3-(2-furylmethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one|2-{[2-(diethylamino)ethyl]amino}-3-(furan-2-ylmethyl)-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C22H30N4O2S |
|---|---|
| Molecular Weight | 414.20895 g/mol |
| LogP | 4.1219 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.20895 |
| Monoisotopic Mass | 414.20895 |
| Heavy Atoms | 29 |
| Complexity | 1002.15625 |
Chemical Identifiers
| CAS Number | 896845-91-3 |
|---|---|
| SMILES | CCN(CC)CCNC1=NC2=C(C3=C(S2)CCCCC3)C(=O)N1CC4=CC=CO4 |
Product Overview
AC1LXYQ9 (CAS 896845-91-3), with molecular formula C22H30N4O2S and molecular weight 414.20895 g/mol. IUPAC: 5-[2-(diethylamino)ethylamino]-4-(furan-2-ylmethyl)-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one.
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