AC1LYN1M
4,4,8-trimethyl-15-methylsulfanyl-N-(2-morpholin-4-ylethyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine
Also Known As: 2,2,5-trimethyl-10-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine|2,2,5-trimethyl-10-(methylthio)-N-(2-morpholinoethyl)-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine|N-(2-MORPHOLINOETHYL)-N-[2,2,5-TRIMETHYL-10-(METHYLSULFANYL)-1,4-DIHYDRO-2H-PYRANO[4'',3'':4',5']PYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDIN-8-YL]AMINE
| Molecular Formula | C22H29N5O2S2 |
|---|---|
| Molecular Weight | 459.17627 g/mol |
| LogP | 3.86522 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.17627 |
| Monoisotopic Mass | 459.17627 |
| Heavy Atoms | 31 |
| Complexity | 1124.4703 |
Chemical Identifiers
| CAS Number | 836629-96-0 |
|---|---|
| SMILES | CC1=C2COC(CC2=C3C4=C(C(=NC(=N4)SC)NCCN5CCOCC5)SC3=N1)(C)C |
Product Overview
AC1LYN1M (CAS 836629-96-0), with molecular formula C22H29N5O2S2 and molecular weight 459.17627 g/mol. IUPAC: 4,4,8-trimethyl-15-methylsulfanyl-N-(2-morpholin-4-ylethyl)-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-amine.
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