2-(azepane-1-sulfonyl)-3-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-3-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-3-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0215 |
| Compound Name: | 2-(azepane-1-sulfonyl)-3-chlorodibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 406.89 |
| Molecular Formula: | C19 H19 Cl N2 O4 S |
| Smiles: | C1CCCN(CC1)S(c1cc2C(Nc3ccccc3Oc2cc1[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.176 |
| logD: | 3.8896 |
| logSw: | -4.5212 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.382 |
| InChI Key: | JSVXBDLJMAUMDU-UHFFFAOYSA-N |