3-(4-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-(4-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-(4-bromophenoxy)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0687 |
| Compound Name: | 3-(4-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(Nc3ccccc3Oc2cc1Oc1ccc(cc1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1435 |
| logD: | 5.121 |
| logSw: | -4.9349 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.735 |
| InChI Key: | QTKQIUZVWRZJBJ-UHFFFAOYSA-N |