AC1LYJ95
2-[(8-butyl-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)amino]ethanol
Also Known As: SR-01000085470-1|2-((5-butyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino)ethanol|2-[(5-butyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino]ethanol
| Molecular Formula | C20H26N4O2S |
|---|---|
| Molecular Weight | 386.17764 g/mol |
| LogP | 3.8376 |
| Topological Polar Surface Area | 80.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.17764 |
| Monoisotopic Mass | 386.17764 |
| Heavy Atoms | 27 |
| Complexity | 983.1721 |
Chemical Identifiers
| CAS Number | 372181-31-2 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(S2)C(=NC=N4)NCCO |
Product Overview
AC1LYJ95 (CAS 372181-31-2), with molecular formula C20H26N4O2S and molecular weight 386.17764 g/mol. IUPAC: 2-[(8-butyl-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)amino]ethanol.
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