3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0486 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 548.66 |
| Molecular Formula: | C29 H32 N4 O5 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)c1cc2c(cc1S(N1CCOCC1)(=O)=O)C(Nc1ccccc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2023 |
| logD: | 5.134 |
| logSw: | -4.9909 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.071 |
| InChI Key: | JUHJNYMZPXMWKC-UHFFFAOYSA-N |