2-chloro-N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-5-(methylsulfanyl)benzamide
Chemical Structure Depiction of
2-chloro-N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-5-(methylsulfanyl)benzamide
2-chloro-N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-5-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8018-7202 |
| Compound Name: | 2-chloro-N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-5-(methylsulfanyl)benzamide |
| Molecular Weight: | 397.88 |
| Molecular Formula: | C21 H16 Cl N O3 S |
| Smiles: | CSc1ccc(c(c1)C(Nc1ccc2c(COc3ccccc3O2)c1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3688 |
| logD: | 5.3686 |
| logSw: | -5.9319 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.924 |
| InChI Key: | JHXQZJRMTGEBHF-UHFFFAOYSA-N |