AC1LYOF8
12-benzyl-16-(2-methylprop-2-enylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one
Also Known As: Oprea1_845896|4-benzyl-1-((2-methylallyl)thio)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one|4-benzyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
| Molecular Formula | C29H30N4OS |
|---|---|
| Molecular Weight | 482.21402 g/mol |
| LogP | 6.0325 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.21402 |
| Monoisotopic Mass | 482.21402 |
| Heavy Atoms | 35 |
| Complexity | 1478.0918 |
Chemical Identifiers
| CAS Number | 373376-91-1 |
|---|---|
| SMILES | CC(=C)CSC1=NN=C2N1C3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63 |
Product Overview
AC1LYOF8 (CAS 373376-91-1), with molecular formula C29H30N4OS and molecular weight 482.21402 g/mol. IUPAC: 12-benzyl-16-(2-methylprop-2-enylsulfanyl)spiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one.
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