AC1LR16Z
N-benzyl-2-[[12,12-dimethyl-4-(3-methylphenyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide
Also Known As: N-benzyl-2-((6,6-dimethyl-4-oxo-3-(m-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide|N-benzyl-2-{[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C27H27N3O3S2 |
|---|---|
| Molecular Weight | 505.14938 g/mol |
| LogP | 5.01542 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.14938 |
| Monoisotopic Mass | 505.14938 |
| Heavy Atoms | 35 |
| Complexity | 1458.0557 |
Chemical Identifiers
| CAS Number | 488100-33-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NCC4=CC=CC=C4)SC5=C3CC(OC5)(C)C |
Product Overview
AC1LR16Z (CAS 488100-33-0), with molecular formula C27H27N3O3S2 and molecular weight 505.14938 g/mol. IUPAC: N-benzyl-2-[[12,12-dimethyl-4-(3-methylphenyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetamide.
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