AC1NA2OF
N-benzyl-2-[(12-ethyl-12-methyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide
Also Known As: N-benzyl-2-((6-ethyl-6-methyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamide|N-Benzyl-2-(6-ethyl-6-methyl-2-propylsulfanyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl sulfanyl)-acetamide|N-benzyl-2-{[6-ethyl-6-methyl-2-(propylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
| Molecular Formula | C24H29N3O2S3 |
|---|---|
| Molecular Weight | 487.14218 g/mol |
| LogP | 5.8433 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.14218 |
| Monoisotopic Mass | 487.14218 |
| Heavy Atoms | 32 |
| Complexity | 1087.033 |
Chemical Identifiers
| CAS Number | 587013-83-0 |
|---|---|
| SMILES | CCCSC1=NC2=C(C3=C(S2)COC(C3)(C)CC)C(=N1)SCC(=O)NCC4=CC=CC=C4 |
Product Overview
AC1NA2OF (CAS 587013-83-0), with molecular formula C24H29N3O2S3 and molecular weight 487.14218 g/mol. IUPAC: N-benzyl-2-[(12-ethyl-12-methyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetamide.
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