AC1LR3LO
ethyl 2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
Also Known As: ethyl {[6,6-dimethyl-3-(4-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate|ethyl 2-((6,6-dimethyl-4-oxo-3-(p-tolyl)-4,5,6,8-tetrahydro-3H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate|ETHYL 2-{[6,6-DIMETHYL-3-(4-METHYLPHENYL)-4-OXO-3,5,6,8-TETRAHYDRO-4H-THIOPYRANO[4',3':4,5]THIENO[2,3-D]PYRIMIDIN-2-YL]SULFANYL}ACETATE
| Molecular Formula | C22H24N2O3S3 |
|---|---|
| Molecular Weight | 460.0949 g/mol |
| LogP | 4.97872 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 460.0949 |
| Monoisotopic Mass | 460.0949 |
| Heavy Atoms | 30 |
| Complexity | 1163.0698 |
Chemical Identifiers
| CAS Number | 488709-13-3 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)CSC(C3)(C)C)C(=O)N1C4=CC=C(C=C4)C |
Product Overview
AC1LR3LO (CAS 488709-13-3), with molecular formula C22H24N2O3S3 and molecular weight 460.0949 g/mol. IUPAC: ethyl 2-[[12,12-dimethyl-4-(4-methylphenyl)-3-oxo-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate.
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