15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine
Chemical Structure Depiction of
15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine
15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine
Compound characteristics
| Compound ID: | 0176-0038 |
| Compound Name: | 15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine |
| Molecular Weight: | 313.31 |
| Molecular Formula: | C14 H19 N O7 |
| Smiles: | C1COCCOc2ccc(cc2OCCOCCO1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.5921 |
| logD: | 0.5921 |
| logSw: | -1.6842 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.5 |
| InChI Key: | XIWRBQVYCZCEPG-UHFFFAOYSA-N |