N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-2-methoxy-4-(methylsulfanyl)benzamide
Chemical Structure Depiction of
N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-2-methoxy-4-(methylsulfanyl)benzamide
N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-2-methoxy-4-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8018-7285 |
| Compound Name: | N-(11H-dibenzo[b,e][1,4]dioxepin-2-yl)-2-methoxy-4-(methylsulfanyl)benzamide |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C22 H19 N O4 S |
| Smiles: | COc1cc(ccc1C(Nc1ccc2c(COc3ccccc3O2)c1)=O)SC |
| Stereo: | ACHIRAL |
| logP: | 4.8036 |
| logD: | 4.802 |
| logSw: | -4.6761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.554 |
| InChI Key: | ZTEBJAWBIQHDST-UHFFFAOYSA-N |