AC1MMEBP
2-[(4,4-dimethyl-15-methylsulfanyl-8-morpholin-4-yl-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]-1-pyrrolidin-1-ylethanone
Also Known As: 2-((2,2-dimethyl-10-(methylthio)-5-morpholino-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)thio)-1-(pyrrolidin-1-yl)ethanone|2-{[2,2-dimethyl-10-(methylsulfanyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
| Molecular Formula | C25H31N5O3S3 |
|---|---|
| Molecular Weight | 545.1589 g/mol |
| LogP | 4.3638 |
| Topological Polar Surface Area | 80.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 545.1589 |
| Monoisotopic Mass | 545.1589 |
| Heavy Atoms | 36 |
| Complexity | 1315.7413 |
Chemical Identifiers
| CAS Number | 848058-75-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC(=N4)SC)SCC(=O)N5CCCC5)N6CCOCC6)C |
Product Overview
AC1MMEBP (CAS 848058-75-3), with molecular formula C25H31N5O3S3 and molecular weight 545.1589 g/mol. IUPAC: 2-[(4,4-dimethyl-15-methylsulfanyl-8-morpholin-4-yl-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]-1-pyrrolidin-1-ylethanone.
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