AC1L6K0X
1',5,17-tributylspiro[5,9,17-triazapentacyclo[10.7.0.02,9.03,7.015,19]nonadeca-10,12-diene-8,3'-pyrrolidine]-2',4,5',6,16,18-hexone
Also Known As: KST-1B3984|1,2',11'-tributyl-3a',9a',12a',12b',12c',12d'-hexahydro-1'h,2h,5h-spiro[pyrrolidine-3,9'-pyrrolo[3,4-h]pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline]-1',2,3',5,10',12'(2'h,4'h,11'h)-hexone|1,2',11'-tributyl-3a',9a',12a',12b',12c',12d'-hexahydro-1'h,|1,2',11'-Tributyl-3'a,9'a,12'a,12'b,12'c,12'd-hexahydro-1'H-spiro[pyrrolidine-3,9'-pyrrolo[3,4-h]pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline]-1',2,3',5,10',12'(2'H,4'H,11'H)-hexone
| Molecular Formula | C31H40N4O6 |
|---|---|
| Molecular Weight | 564.2948 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 564.2948 |
| Monoisotopic Mass | 564.2948 |
| Heavy Atoms | 41 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 40374-17-2 |
|---|---|
| SMILES | CCCCN1C(=O)CC2(C1=O)C3C(C4N2C=CC5=CCC6C(C45)C(=O)N(C6=O)CCCC)C(=O)N(C3=O)CCCC |
| InChIKey | CCCYCGIPXQEBNK-UHFFFAOYSA-N |
Product Overview
AC1L6K0X (CAS 40374-17-2), with molecular formula C31H40N4O6 and molecular weight 564.2948 g/mol. IUPAC: 1',5,17-tributylspiro[5,9,17-triazapentacyclo[10.7.0.02,9.03,7.015,19]nonadeca-10,12-diene-8,3'-pyrrolidine]-2',4,5',6,16,18-hexone.
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