AC1LY02O
N-(2-methylphenyl)-2-[(7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetamide
Also Known As: 2-((5-(methylthio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-N-(o-tolyl)acetamide|N-(2-methylphenyl)-2-{[5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
| Molecular Formula | C21H21N5OS3 |
|---|---|
| Molecular Weight | 455.09082 g/mol |
| LogP | 4.97892 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.09082 |
| Monoisotopic Mass | 455.09082 |
| Heavy Atoms | 30 |
| Complexity | 1262.7295 |
Chemical Identifiers
| CAS Number | 799809-39-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCCC5)SC |
Product Overview
AC1LY02O (CAS 799809-39-5), with molecular formula C21H21N5OS3 and molecular weight 455.09082 g/mol. IUPAC: N-(2-methylphenyl)-2-[(7-methylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetamide.
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