2-(pyrrolidine-1-sulfonyl)-3-(thiomorpholin-4-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(pyrrolidine-1-sulfonyl)-3-(thiomorpholin-4-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(pyrrolidine-1-sulfonyl)-3-(thiomorpholin-4-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0455 |
| Compound Name: | 2-(pyrrolidine-1-sulfonyl)-3-(thiomorpholin-4-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C21 H23 N3 O4 S2 |
| Smiles: | C1CCN(C1)S(c1cc2C(Nc3ccccc3Oc2cc1N1CCSCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5272 |
| logD: | 3.4589 |
| logSw: | -3.9231 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.568 |
| InChI Key: | ZGFASXBJJBMNKE-UHFFFAOYSA-N |