RefChem:447633
2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 2-((2-(4-Ethoxyphenyl)-2-oxoethyl)thio)-3-ethyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|2-{[2-(4-ETHOXYPHENYL)-2-OXOETHYL]SULFANYL}-3-ETHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE|2-((2-(4-ETHOXYPHENYL)-2-OXOETHYL)SULFANYL)-3-ETHYL-5,6,7,8-TETRAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-4(3H)-ONE|2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-[2-(4-ethoxyphenyl)-2-oxoethylthio]-3-ethyl-3,5,6,7,8-pentahydrobenzo[b]thio pheno[2,3-d]pyrimidin-4-one|5-{[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl}-4-ethyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|638-234-6
| Molecular Formula | C22H24N2O3S2 |
|---|---|
| Molecular Weight | 428.12283 g/mol |
| LogP | 4.7304 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.12283 |
| Monoisotopic Mass | 428.12283 |
| Heavy Atoms | 29 |
| Complexity | 1099.9282 |
Chemical Identifiers
| CAS Number | 577700-25-5 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)OCC)SC4=C2CCCC4 |
Product Overview
RefChem:447633 (CAS 577700-25-5), with molecular formula C22H24N2O3S2 and molecular weight 428.12283 g/mol. IUPAC: 2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.