AC1MWW2B
3-(4-ethoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 3-(4-ETHOXYPHENYL)-2-[(1-NAPHTHYLMETHYL)SULFANYL]-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE|3-(4-ethoxyphenyl)-2-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|3-(4-ethoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|3-(4-ethoxyphenyl)-2-(naphthylmethylthio)-3,5,6,7,8-pentahydrobenzo[b]thiophen o[2,3-d]pyrimidin-4-one|3-(4-ethoxyphenyl)-2-[(naphthalen-1-ylmethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C29H26N2O2S2 |
|---|---|
| Molecular Weight | 498.1436 g/mol |
| LogP | 7.1702 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.1436 |
| Monoisotopic Mass | 498.1436 |
| Heavy Atoms | 35 |
| Complexity | 1579.7274 |
Chemical Identifiers
| CAS Number | 613226-83-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC5=CC=CC=C54)SC6=C3CCCC6 |
Product Overview
AC1MWW2B (CAS 613226-83-8), with molecular formula C29H26N2O2S2 and molecular weight 498.1436 g/mol. IUPAC: 3-(4-ethoxyphenyl)-2-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
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