AC1MJCNP
5-(2,4-dimethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
Also Known As: Oprea1_477096|Oprea1_607558|AK-778/11118021|SR-01000400659-1|2-(2,4-dimethoxyphenyl)-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one|2-(2,4-dimethoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
CAS: 442534-85-2
| Molecular Formula | C18H21N3O3S |
|---|---|
| Molecular Weight | 359.13037 g/mol |
| LogP | 2.6073 |
| Topological Polar Surface Area | 62.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.13037 |
| Monoisotopic Mass | 359.13037 |
| Heavy Atoms | 25 |
| Complexity | 833.21405 |
Chemical Identifiers
| CAS Number | 442534-85-2 |
|---|---|
| SMILES | CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=C(C=C4)OC)OC |
Product Overview
AC1MJCNP (CAS 442534-85-2), with molecular formula C18H21N3O3S and molecular weight 359.13037 g/mol. IUPAC: 5-(2,4-dimethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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