6-chloro-3-(4-methylbenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
6-chloro-3-(4-methylbenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-2H-1-benzopyran-2-imine
6-chloro-3-(4-methylbenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0264 |
| Compound Name: | 6-chloro-3-(4-methylbenzene-1-sulfonyl)-N-[3-(methylsulfanyl)phenyl]-2H-1-benzopyran-2-imine |
| Molecular Weight: | 455.98 |
| Molecular Formula: | C23 H18 Cl N O3 S2 |
| Smiles: | Cc1ccc(cc1)S(C1=Cc2cc(ccc2OC/1=N/c1cccc(c1)SC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9717 |
| logD: | 5.9717 |
| logSw: | -6.2272 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.446 |
| InChI Key: | BZAIIMPRBHCDOA-UHFFFAOYSA-N |