1-tert-butyl-3'-methyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-2,4,6-trione
Chemical Structure Depiction of
1-tert-butyl-3'-methyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-2,4,6-trione
1-tert-butyl-3'-methyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-2,4,6-trione
Compound characteristics
| Compound ID: | 8018-5295 |
| Compound Name: | 1-tert-butyl-3'-methyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-2,4,6-trione |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C21 H26 N4 O5 |
| Smiles: | CC1CCN2C(C1)C1(Cc3cc(ccc23)[N+]([O-])=O)C(NC(N(C1=O)C(C)(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.118 |
| logD: | 3.115 |
| logSw: | -3.4163 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.11 |
| InChI Key: | YEPHOXHJHDAUQS-UHFFFAOYSA-N |