2,16-dinitro-6,7,9,10,12,13,20,21,23,24-decahydrodibenzo[b,k][1,4,7,10,13,16,19]heptaoxacyclohenicosine
Chemical Structure Depiction of
2,16-dinitro-6,7,9,10,12,13,20,21,23,24-decahydrodibenzo[b,k][1,4,7,10,13,16,19]heptaoxacyclohenicosine
2,16-dinitro-6,7,9,10,12,13,20,21,23,24-decahydrodibenzo[b,k][1,4,7,10,13,16,19]heptaoxacyclohenicosine
Compound characteristics
| Compound ID: | 0097-0015 |
| Compound Name: | 2,16-dinitro-6,7,9,10,12,13,20,21,23,24-decahydrodibenzo[b,k][1,4,7,10,13,16,19]heptaoxacyclohenicosine |
| Molecular Weight: | 494.45 |
| Molecular Formula: | C22 H26 N2 O11 |
| Smiles: | C1COCCOc2cc(ccc2OCCOCCOc2cc(ccc2OCCO1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.472 |
| logD: | 1.472 |
| logSw: | -1.9458 |
| Hydrogen bond acceptors count: | 15 |
| Polar surface area: | 122.512 |
| InChI Key: | HUEHVPNKLNTJSZ-UHFFFAOYSA-N |