AC1LY8FQ
4,4-dimethyl-8-(2-methylpropyl)-13-[(4-propan-2-yloxyphenyl)methylsulfanyl]-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-hexaene
Also Known As: Oprea1_403407|2,2-dimethyl-5-(2-methylpropyl)-8-{[4-(propan-2-yloxy)benzyl]sulfanyl}-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine|5-isobutyl-8-((4-isopropoxybenzyl)thio)-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C28H33N3O2S2 |
|---|---|
| Molecular Weight | 507.20142 g/mol |
| LogP | 7.3688 |
| Topological Polar Surface Area | 57.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.20142 |
| Monoisotopic Mass | 507.20142 |
| Heavy Atoms | 35 |
| Complexity | 1360.6483 |
Chemical Identifiers
| CAS Number | 799786-22-4 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(S2)C(=NC=N4)SCC5=CC=C(C=C5)OC(C)C |
Product Overview
AC1LY8FQ (CAS 799786-22-4), with molecular formula C28H33N3O2S2 and molecular weight 507.20142 g/mol. IUPAC: 4,4-dimethyl-8-(2-methylpropyl)-13-[(4-propan-2-yloxyphenyl)methylsulfanyl]-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-hexaene.
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