1'-(4-methoxyphenyl)-3-nitro-6a,7,8,9,10,11-hexahydro-5H-spiro[azepino[1,2-a]quinoline-6,5'-[1,3]diazinane]-2',4',6'-trione
Chemical Structure Depiction of
1'-(4-methoxyphenyl)-3-nitro-6a,7,8,9,10,11-hexahydro-5H-spiro[azepino[1,2-a]quinoline-6,5'-[1,3]diazinane]-2',4',6'-trione
1'-(4-methoxyphenyl)-3-nitro-6a,7,8,9,10,11-hexahydro-5H-spiro[azepino[1,2-a]quinoline-6,5'-[1,3]diazinane]-2',4',6'-trione
Compound characteristics
| Compound ID: | 8018-2117 |
| Compound Name: | 1'-(4-methoxyphenyl)-3-nitro-6a,7,8,9,10,11-hexahydro-5H-spiro[azepino[1,2-a]quinoline-6,5'-[1,3]diazinane]-2',4',6'-trione |
| Molecular Weight: | 464.48 |
| Molecular Formula: | C24 H24 N4 O6 |
| Smiles: | COc1ccc(cc1)N1C(C2(Cc3cc(ccc3N3CCCCCC23)[N+]([O-])=O)C(NC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3779 |
| logD: | 3.2334 |
| logSw: | -3.7584 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.018 |
| InChI Key: | OYXOJEHXLWFDSD-UHFFFAOYSA-N |