AC1LCZD9
ethyl 2-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate
Also Known As: CBMicro_027089|NCGC00018491-01|BIM-0026917.P001|AE-848/31941050|SR-01000215707-1|ethyl [(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate|ethyl [(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio]acetate|ethyl 2-((6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
| Molecular Formula | C15H18N2O4S2 |
|---|---|
| Molecular Weight | 354.0708 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.0708 |
| Monoisotopic Mass | 354.0708 |
| Heavy Atoms | 23 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 372184-27-5 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1 |
| InChIKey | BLHWWTBJBKLNDT-UHFFFAOYSA-N |
Product Overview
AC1LCZD9 (CAS 372184-27-5), with molecular formula C15H18N2O4S2 and molecular weight 354.0708 g/mol. IUPAC: ethyl 2-[(12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl)sulfanyl]acetate.