AC1LCY0F
methyl 5-(1-amino-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)furan-2-carboxylate
Also Known As: regid856745|Oprea1_605033|NCGC00018750-01|NCGC00018750-02|NCGC00018750-03|methyl 5-(1-amino-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)furan-2-carboxylate|5-(1-amino-5-morpholino-6,7,8,9-tetrahydrothien[2,3-c]isoquinolin-2-yl)furan-2-carboxylic acid methyl ester|5-[1-amino-5-(4-morpholinyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl]-2-furancarboxylic acid methyl ester|methyl 5-(1-amino-5-morpholino-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)furan-2-carboxylate|methyl 5-(1-azanyl-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)furan-2-carboxylate|methyl 5-[1-amino-5-(4-morpholinyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl]-2-furoate
| Molecular Formula | C21H23N3O4S |
|---|---|
| Molecular Weight | 413.14093 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.14093 |
| Monoisotopic Mass | 413.14093 |
| Heavy Atoms | 29 |
| Complexity | 604.0 |
Chemical Identifiers
| CAS Number | 369609-53-0 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)C2=C(C3=C(S2)N=C(C4=C3CCCC4)N5CCOCC5)N |
| InChIKey | PTCFPQFBIUFIAV-UHFFFAOYSA-N |
Product Overview
AC1LCY0F (CAS 369609-53-0), with molecular formula C21H23N3O4S and molecular weight 413.14093 g/mol. IUPAC: methyl 5-(1-amino-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)furan-2-carboxylate.