AC1LUQ1N
pentyl 2-[[3-(2-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate
Also Known As: AJ-292/41342184|pentyl {[3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate|pentyl 2-[[3-(2-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate|pentyl 2-((4-oxo-3-(o-tolyl)-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
| Molecular Formula | C24H28N2O3S2 |
|---|---|
| Molecular Weight | 456.15414 g/mol |
| LogP | 5.45992 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.15414 |
| Monoisotopic Mass | 456.15414 |
| Heavy Atoms | 31 |
| Complexity | 1149.6674 |
Chemical Identifiers
| CAS Number | 4633-44-7 |
|---|---|
| SMILES | CCCCCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4C |
Product Overview
AC1LUQ1N (CAS 4633-44-7), with molecular formula C24H28N2O3S2 and molecular weight 456.15414 g/mol. IUPAC: pentyl 2-[[3-(2-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate.
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