2-(azepane-1-sulfonyl)-8-methyl-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-8-methyl-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-8-methyl-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-1163 |
| Compound Name: | 2-(azepane-1-sulfonyl)-8-methyl-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C26 H26 N2 O5 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)Oc1ccccc1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3306 |
| logD: | 5.3156 |
| logSw: | -5.1888 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.216 |
| InChI Key: | DCROFYZQKSCTAA-UHFFFAOYSA-N |