AC1NFZ06
2-[(5-butylsulfanyl-12-ethyl-12-methyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide
Also Known As: 2-((2-(butylthio)-6-ethyl-6-methyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-N-(furan-2-ylmethyl)acetamide|2-(2-Butylsulfanyl-6-ethyl-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-ylsulfanyl)-N -furan-2-ylmethyl-acetamide|2-{[2-(butylsulfanyl)-6-ethyl-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-(furan-2-ylmethyl)acetamide
| Molecular Formula | C23H29N3O3S3 |
|---|---|
| Molecular Weight | 491.13712 g/mol |
| LogP | 5.8264 |
| Topological Polar Surface Area | 77.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 491.13712 |
| Monoisotopic Mass | 491.13712 |
| Heavy Atoms | 32 |
| Complexity | 1067.5564 |
Chemical Identifiers
| CAS Number | 847039-75-2 |
|---|---|
| SMILES | CCCCSC1=NC2=C(C3=C(S2)COC(C3)(C)CC)C(=N1)SCC(=O)NCC4=CC=CO4 |
Product Overview
AC1NFZ06 (CAS 847039-75-2), with molecular formula C23H29N3O3S3 and molecular weight 491.13712 g/mol. IUPAC: 2-[(5-butylsulfanyl-12-ethyl-12-methyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]-N-(furan-2-ylmethyl)acetamide.