AC1MR7BD
7-methyl-3-octyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 11-Methyl-4-octyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one|2-Mercapto-7-methyl-3-octyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one|7-methyl-3-octyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one|11-methyl-4-octyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|2-Mercapto-7-methyl-3-octyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3h)-one|7-methyl-3-octyl-2-thioxo-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one|11-methyl-4-octyl-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0?,?]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C19H28N2OS2 |
|---|---|
| Molecular Weight | 364.1643 g/mol |
| LogP | 5.60589 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 364.1643 |
| Monoisotopic Mass | 364.1643 |
| Heavy Atoms | 24 |
| Complexity | 815.10675 |
Chemical Identifiers
| CAS Number | 519151-95-2 |
|---|---|
| SMILES | CCCCCCCCN1C(=O)C2=C(NC1=S)SC3=C2CCC(C3)C |
Product Overview
AC1MR7BD (CAS 519151-95-2), with molecular formula C19H28N2OS2 and molecular weight 364.1643 g/mol. IUPAC: 7-methyl-3-octyl-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one.