16-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-amine
Chemical Structure Depiction of
16-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-amine
16-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-amine
Compound characteristics
| Compound ID: | 0177-0053 |
| Compound Name: | 16-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-amine |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C14 H20 N2 O7 |
| Smiles: | C1COCCOc2cc(c(cc2OCCOCCO1)[N+]([O-])=O)N |
| Stereo: | ACHIRAL |
| logP: | 0.141 |
| logD: | 0.141 |
| logSw: | -1.2526 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.295 |
| InChI Key: | PSFJQUGCUJJHIS-UHFFFAOYSA-N |