AC1LKGRO
3-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-7-methyl-15-thia-2,4,5,7-tetrazatetracyclo[7.6.0.02,6.010,14]pentadeca-1(9),3,5,10(14)-tetraen-8-one
Also Known As: CBMicro_018199|ChemDiv1_009996|Oprea1_242081|Oprea1_310514|HMS615G08|BAS 02376406|BIM-0018133.P001|AN-512/12673380|SR-01000492290-1|1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one|1-((2-(4-bromophenyl)-2-oxoethyl)thio)-4-methyl-7,8-dihydro-4H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(6H)-one
| Molecular Formula | C19H15BrN4O2S2 |
|---|---|
| Molecular Weight | 473.982 g/mol |
| LogP | 3.8689 |
| Topological Polar Surface Area | 69.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.982 |
| Monoisotopic Mass | 473.982 |
| Heavy Atoms | 28 |
| Complexity | 1303.9531 |
Chemical Identifiers
| CAS Number | 351007-97-1 |
|---|---|
| SMILES | CN1C(=O)C2=C(N3C1=NN=C3SCC(=O)C4=CC=C(C=C4)Br)SC5=C2CCC5 |
Product Overview
AC1LKGRO (CAS 351007-97-1), with molecular formula C19H15BrN4O2S2 and molecular weight 473.982 g/mol. IUPAC: 3-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-7-methyl-15-thia-2,4,5,7-tetrazatetracyclo[7.6.0.02,6.010,14]pentadeca-1(9),3,5,10(14)-tetraen-8-one.