AC1NKC3S
1'-butyl-1-hexyl-6'-nitro-2'-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
Also Known As: 1'-butyl-1-hexyl-6'-nitro-2'-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione|1'-butyl-1-hexyl-6'-nitro-2'-propyl-spiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione|1'-butyl-1-hexyl-6'-nitro-2'-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione|1'-butyl-3-hexyl-6-hydroxy-6'-nitro-2'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
| Molecular Formula | C25H36N4O5 |
|---|---|
| Molecular Weight | 472.2686 g/mol |
| LogP | 4.5712 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 472.2686 |
| Monoisotopic Mass | 472.2686 |
| Heavy Atoms | 34 |
| Complexity | 949.23376 |
Chemical Identifiers
| CAS Number | 879449-36-2 |
|---|---|
| SMILES | CCCCCCN1C(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N(C2CCC)CCCC)C(=O)NC1=O |
Product Overview
AC1NKC3S (CAS 879449-36-2), with molecular formula C25H36N4O5 and molecular weight 472.2686 g/mol. IUPAC: 1'-butyl-1-hexyl-6'-nitro-2'-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione.
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