AC1LGAV0
11-(4-methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: BAS 01258566|AJ-292/13049075|SR-01000465279-1|3-(4-methylphenyl)-2-(methylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one|11-(4-Methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one|2-(4-methylphenyl)-3-methylsulfanyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one|2-(methylthio)-3-(p-tolyl)-6,7-dihydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one
| Molecular Formula | C17H16N2OS2 |
|---|---|
| Molecular Weight | 328.0704 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.0704 |
| Monoisotopic Mass | 328.0704 |
| Heavy Atoms | 22 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 337351-75-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=C3CCC4 |
| InChIKey | DDXPEKZUCFDDTL-UHFFFAOYSA-N |
Product Overview
AC1LGAV0 (CAS 337351-75-4), with molecular formula C17H16N2OS2 and molecular weight 328.0704 g/mol. IUPAC: 11-(4-methylphenyl)-10-methylsulfanyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.