6-(4-chlorophenyl)-2,4-dinitro-6,7-dihydro-5H-dibenzo[b,g][1,5]oxazocin-5-one
Chemical Structure Depiction of
6-(4-chlorophenyl)-2,4-dinitro-6,7-dihydro-5H-dibenzo[b,g][1,5]oxazocin-5-one
6-(4-chlorophenyl)-2,4-dinitro-6,7-dihydro-5H-dibenzo[b,g][1,5]oxazocin-5-one
Compound characteristics
| Compound ID: | 8017-1187 |
| Compound Name: | 6-(4-chlorophenyl)-2,4-dinitro-6,7-dihydro-5H-dibenzo[b,g][1,5]oxazocin-5-one |
| Molecular Weight: | 425.78 |
| Molecular Formula: | C20 H12 Cl N3 O6 |
| Smiles: | C1c2ccccc2Oc2cc(cc(c2C(N1c1ccc(cc1)[Cl])=O)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0184 |
| logD: | 5.0184 |
| logSw: | -5.5399 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.759 |
| InChI Key: | RLKNNVXGWSBNJC-UHFFFAOYSA-N |