AC1LR9NX
N-benzyl-2-[(8-ethyl-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)sulfanyl]acetamide
Also Known As: N-benzyl-2-((5-ethyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)thio)acetamide|N-benzyl-2-[(5-ethyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetamide
| Molecular Formula | C25H26N4O2S2 |
|---|---|
| Molecular Weight | 478.14972 g/mol |
| LogP | 5.0617 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.14972 |
| Monoisotopic Mass | 478.14972 |
| Heavy Atoms | 33 |
| Complexity | 1335.0007 |
Chemical Identifiers
| CAS Number | 488087-75-8 |
|---|---|
| SMILES | CCC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(S2)C(=NC=N4)SCC(=O)NCC5=CC=CC=C5 |
Product Overview
AC1LR9NX (CAS 488087-75-8), with molecular formula C25H26N4O2S2 and molecular weight 478.14972 g/mol. IUPAC: N-benzyl-2-[(8-ethyl-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)sulfanyl]acetamide.
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