AC1LOX9J
2-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 2-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|2-((2-(2,5-Dimethoxyphenyl)-2-oxoethyl)thio)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|2-((2-(2,5-DIMETHOXYPHENYL)-2-OXOETHYL)SULFANYL)-3-(4-METHOXYPHENYL)-5,6,7,8-TETRAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-4(3H)-ONE|2-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-[2-(2,5-dimethoxyphenyl)-2-oxoethylthio]-3-(4-methoxyphenyl)-3,5,6,7,8-penta hydrobenzo[b]thiopheno[2,3-d]pyrimidin-4-one|5-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|650-716-8
| Molecular Formula | C27H26N2O5S2 |
|---|---|
| Molecular Weight | 522.1283 g/mol |
| LogP | 5.3268 |
| Topological Polar Surface Area | 79.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 522.1283 |
| Monoisotopic Mass | 522.1283 |
| Heavy Atoms | 36 |
| Complexity | 1491.0642 |
Chemical Identifiers
| CAS Number | 477331-64-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=C(C=CC(=C4)OC)OC)SC5=C3CCCC5 |
Product Overview
AC1LOX9J (CAS 477331-64-9), with molecular formula C27H26N2O5S2 and molecular weight 522.1283 g/mol. IUPAC: 2-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.