AC1M0O4L
2-[(7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]-1-pyrrolidin-1-ylethanone
Also Known As: 2-((4-isopropyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)thio)-1-(pyrrolidin-1-yl)ethanone|2-{[4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
| Molecular Formula | C21H24N4OS2 |
|---|---|
| Molecular Weight | 412.13916 g/mol |
| LogP | 4.5661 |
| Topological Polar Surface Area | 58.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.13916 |
| Monoisotopic Mass | 412.13916 |
| Heavy Atoms | 28 |
| Complexity | 1069.3789 |
Chemical Identifiers
| CAS Number | 848745-48-2 |
|---|---|
| SMILES | CC(C)C1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC(=O)N5CCCC5 |
Product Overview
AC1M0O4L (CAS 848745-48-2), with molecular formula C21H24N4OS2 and molecular weight 412.13916 g/mol. IUPAC: 2-[(7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]-1-pyrrolidin-1-ylethanone.
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