AC1LYJAW
N-(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)-N',N'-diethylethane-1,2-diamine
Also Known As: Oprea1_097692|Oprea1_766845|N'-(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)-N,N-diethylethane-1,2-diamine|N-(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)-N-[2-(DIETHYLAMINO)ETHYL]AMINE|N1-(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)-N2,N2-diethylethane-1,2-diamine
| Molecular Formula | C24H35N5OS |
|---|---|
| Molecular Weight | 441.25623 g/mol |
| LogP | 5.1871 |
| Topological Polar Surface Area | 63.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 441.25623 |
| Monoisotopic Mass | 441.25623 |
| Heavy Atoms | 31 |
| Complexity | 1057.2261 |
Chemical Identifiers
| CAS Number | 372181-76-5 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(S2)C(=NC=N4)NCCN(CC)CC |
Product Overview
AC1LYJAW (CAS 372181-76-5), with molecular formula C24H35N5OS and molecular weight 441.25623 g/mol. IUPAC: N-(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)-N',N'-diethylethane-1,2-diamine.
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