N-(2-hydroxyethyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Chemical Structure Depiction of
N-(2-hydroxyethyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
N-(2-hydroxyethyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Compound characteristics
| Compound ID: | 8015-9319 |
| Compound Name: | N-(2-hydroxyethyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide |
| Molecular Weight: | 326.31 |
| Molecular Formula: | C17 H14 N2 O5 |
| Smiles: | C(CO)NC(c1cc(cc2c1C=Cc1ccccc1O2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.597 |
| logD: | 2.597 |
| logSw: | -3.3395 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.947 |
| InChI Key: | IASFWYDGHBHTIY-UHFFFAOYSA-N |