3-(2-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-(2-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-(2-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0686 |
| Compound Name: | 3-(2-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 503.37 |
| Molecular Formula: | C22 H19 Br N2 O5 S |
| Smiles: | CCN(C)S(c1cc2C(Nc3ccccc3Oc2cc1Oc1ccccc1[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9238 |
| logD: | 4.9013 |
| logSw: | -4.5574 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.822 |
| InChI Key: | PFGSHPAMWYDGCJ-UHFFFAOYSA-N |