AC1LZRB6
13-benzyl-7-(3-methylphenyl)-3-methylsulfanyl-16-thia-2,4,5,7,13-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: 8-benzyl-1-(methylthio)-4-(m-tolyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one|8-benzyl-4-(3-methylphenyl)-1-(methylsulfanyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
| Molecular Formula | C25H23N5OS2 |
|---|---|
| Molecular Weight | 473.1344 g/mol |
| LogP | 4.68352 |
| Topological Polar Surface Area | 55.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 473.1344 |
| Monoisotopic Mass | 473.1344 |
| Heavy Atoms | 33 |
| Complexity | 1550.4188 |
Chemical Identifiers
| CAS Number | 488802-11-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SC)SC5=C3CCN(C5)CC6=CC=CC=C6 |
Product Overview
AC1LZRB6 (CAS 488802-11-5), with molecular formula C25H23N5OS2 and molecular weight 473.1344 g/mol. IUPAC: 13-benzyl-7-(3-methylphenyl)-3-methylsulfanyl-16-thia-2,4,5,7,13-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
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