2-(azepane-1-sulfonyl)-3-(4-methylpiperidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-3-(4-methylpiperidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-3-(4-methylpiperidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0762 |
| Compound Name: | 2-(azepane-1-sulfonyl)-3-(4-methylpiperidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C25 H31 N3 O4 S |
| Smiles: | CC1CCN(CC1)c1cc2c(cc1S(N1CCCCCC1)(=O)=O)C(Nc1ccccc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2591 |
| logD: | 5.1909 |
| logSw: | -5.0232 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.534 |
| InChI Key: | XQQGRCIDNYYDOJ-UHFFFAOYSA-N |