6,8-dichloro-N-(2,4-dimethylphenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Chemical Structure Depiction of
6,8-dichloro-N-(2,4-dimethylphenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
6,8-dichloro-N-(2,4-dimethylphenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide
Compound characteristics
| Compound ID: | 8017-5004 |
| Compound Name: | 6,8-dichloro-N-(2,4-dimethylphenyl)-3-nitrodibenzo[b,f]oxepine-1-carboxamide |
| Molecular Weight: | 455.3 |
| Molecular Formula: | C23 H16 Cl2 N2 O4 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1cc(cc2c1C=Cc1cc(cc(c1O2)[Cl])[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7208 |
| logD: | 6.7182 |
| logSw: | -6.4176 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.842 |
| InChI Key: | LNPXLIMNJIXCTA-UHFFFAOYSA-N |