N-(2,5-dimethylphenyl)-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
N-(2,5-dimethylphenyl)-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
Compound characteristics
Compound ID: | C585-0072 |
Compound Name: | N-(2,5-dimethylphenyl)-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine |
Molecular Weight: | 403.5 |
Molecular Formula: | C24 H21 N O3 S |
Smiles: | Cc1ccc(cc1)S(C1=Cc2ccccc2OC/1=N/c1cc(C)ccc1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.7432 |
logD: | 5.743 |
logSw: | -5.5839 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.748 |
InChI Key: | OGVHWWXPWQQVJS-UHFFFAOYSA-N |