AC1Q2YUP
N,N-diethyl-2-[[3-(furan-2-ylmethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: N,N-diethyl-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide|N,N-diethyl-2-((3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide|N,N-diethyl-2-[[3-(furan-2-ylmethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide|N,N-diethyl-2-[3-(2-furylmethyl)-4-oxo(3,5,6,7,8-pentahydrobenzo[b]thiopheno[2 ,3-d]pyrimidin-2-ylthio)]acetamide|N,N-diethyl-2-{[4-(furan-2-ylmethyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}acetamide
| Molecular Formula | C21H25N3O3S2 |
|---|---|
| Molecular Weight | 431.13373 g/mol |
| LogP | 3.9386 |
| Topological Polar Surface Area | 68.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.13373 |
| Monoisotopic Mass | 431.13373 |
| Heavy Atoms | 29 |
| Complexity | 1065.2114 |
Chemical Identifiers
| CAS Number | 577963-71-4 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4=CC=CO4 |
Product Overview
AC1Q2YUP (CAS 577963-71-4), with molecular formula C21H25N3O3S2 and molecular weight 431.13373 g/mol. IUPAC: N,N-diethyl-2-[[3-(furan-2-ylmethyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide.