AC1LZQE8
8-(furan-2-yl)-4,4-dimethyl-15-methylsulfanyl-13-(2-phenylethylsulfanyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Also Known As: 5-(furan-2-yl)-2,2-dimethyl-10-(methylsulfanyl)-8-[(2-phenylethyl)sulfanyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine|5-(furan-2-yl)-2,2-dimethyl-10-(methylthio)-8-(phenethylthio)-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C27H25N3O2S3 |
|---|---|
| Molecular Weight | 519.1109 g/mol |
| LogP | 7.4075 |
| Topological Polar Surface Area | 61.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 519.1109 |
| Monoisotopic Mass | 519.1109 |
| Heavy Atoms | 35 |
| Complexity | 1512.063 |
Chemical Identifiers
| CAS Number | 845902-31-0 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC(=N4)SC)SCCC5=CC=CC=C5)C6=CC=CO6)C |
Product Overview
AC1LZQE8 (CAS 845902-31-0), with molecular formula C27H25N3O2S3 and molecular weight 519.1109 g/mol. IUPAC: 8-(furan-2-yl)-4,4-dimethyl-15-methylsulfanyl-13-(2-phenylethylsulfanyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene.
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