2-chloro-N-[3-(1,3-dioxan-2-yl)phenyl]-5-(methylsulfanyl)benzamide
Chemical Structure Depiction of
2-chloro-N-[3-(1,3-dioxan-2-yl)phenyl]-5-(methylsulfanyl)benzamide
2-chloro-N-[3-(1,3-dioxan-2-yl)phenyl]-5-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8012-2517 |
| Compound Name: | 2-chloro-N-[3-(1,3-dioxan-2-yl)phenyl]-5-(methylsulfanyl)benzamide |
| Molecular Weight: | 363.86 |
| Molecular Formula: | C18 H18 Cl N O3 S |
| Smiles: | CSc1ccc(c(c1)C(Nc1cccc(c1)C1OCCCO1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4711 |
| logD: | 3.471 |
| logSw: | -3.8979 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.745 |
| InChI Key: | BUGBTYJIIFCGDE-UHFFFAOYSA-N |