2-(azepane-1-sulfonyl)-3-(4-chlorophenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-3-(4-chlorophenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-3-(4-chlorophenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0723 |
| Compound Name: | 2-(azepane-1-sulfonyl)-3-(4-chlorophenoxy)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 498.98 |
| Molecular Formula: | C25 H23 Cl N2 O5 S |
| Smiles: | C1CCCN(CC1)S(c1cc2C(Nc3ccccc3Oc2cc1Oc1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.87 |
| logD: | 5.8474 |
| logSw: | -6.0278 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.216 |
| InChI Key: | STWJJRADVSKNNQ-UHFFFAOYSA-N |