2-(azepane-1-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0101 |
| Compound Name: | 2-(azepane-1-sulfonyl)-8-methyldibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C20 H22 N2 O4 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(ccc1O2)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7472 |
| logD: | 3.7175 |
| logSw: | -3.9481 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.382 |
| InChI Key: | OYQJSBIPRAANND-UHFFFAOYSA-N |