3-(2-bromophenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-(2-bromophenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-(2-bromophenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0441 |
| Compound Name: | 3-(2-bromophenoxy)-2-(pyrrolidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 515.38 |
| Molecular Formula: | C23 H19 Br N2 O5 S |
| Smiles: | C1CCN(C1)S(c1cc2C(Nc3ccccc3Oc2cc1Oc1ccccc1[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.063 |
| logD: | 5.0404 |
| logSw: | -4.8478 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.338 |
| InChI Key: | AEMXIKKLSNIODG-UHFFFAOYSA-N |