13,13-diethyl-6-methyl-10-nitro-6H,11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine
Chemical Structure Depiction of
13,13-diethyl-6-methyl-10-nitro-6H,11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine
13,13-diethyl-6-methyl-10-nitro-6H,11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine
Compound characteristics
| Compound ID: | 2714-0006 |
| Compound Name: | 13,13-diethyl-6-methyl-10-nitro-6H,11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine |
| Molecular Weight: | 354.4 |
| Molecular Formula: | C20 H22 N2 O4 |
| Smiles: | [H]C1(C)N2C(c3cc(ccc3O1)[N+]([O-])=O)OC(CC)(CC)c1ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1372 |
| logD: | 5.1372 |
| logSw: | -5.04 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.744 |
| InChI Key: | VCQQTGZTHRRFRJ-UHFFFAOYSA-N |