AC1MV4W1
2-[(7-butylsulfanyl-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]-N,N-dimethylethanamine
Also Known As: 2-((5-(butylthio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-N,N-dimethylethanamine|2-{[5-(butylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N,N-dimethylethanamine
| Molecular Formula | C19H27N5S3 |
|---|---|
| Molecular Weight | 421.14285 g/mol |
| LogP | 4.7637 |
| Topological Polar Surface Area | 46.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.14285 |
| Monoisotopic Mass | 421.14285 |
| Heavy Atoms | 27 |
| Complexity | 930.6011 |
Chemical Identifiers
| CAS Number | 862192-83-4 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCCN(C)C |
Product Overview
AC1MV4W1 (CAS 862192-83-4), with molecular formula C19H27N5S3 and molecular weight 421.14285 g/mol. IUPAC: 2-[(7-butylsulfanyl-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]-N,N-dimethylethanamine.
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