AC1MXJ8F
5-(4-ethoxyphenyl)-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_459252|2-(4-ethoxyphenyl)-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one|2-(4-ethoxyphenyl)-7-methyl-1,2,3,5,6,8-hexahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one|2-(4-ethoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
CAS: 420107-26-2
| Molecular Formula | C18H21N3O2S |
|---|---|
| Molecular Weight | 343.13544 g/mol |
| LogP | 2.9888 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.13544 |
| Monoisotopic Mass | 343.13544 |
| Heavy Atoms | 24 |
| Complexity | 769.3162 |
Chemical Identifiers
| CAS Number | 420107-26-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2NC3=C(C4=C(S3)CN(CC4)C)C(=O)N2 |
Product Overview
AC1MXJ8F (CAS 420107-26-2), with molecular formula C18H21N3O2S and molecular weight 343.13544 g/mol. IUPAC: 5-(4-ethoxyphenyl)-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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