3-[1-(4-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[1-(4-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-2H-1-benzopyran-2-one
3-[1-(4-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K241-0242 |
| Compound Name: | 3-[1-(4-methoxyphenyl)-2-sulfanylidene-2,3-dihydro-1H-imidazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 350.39 |
| Molecular Formula: | C19 H14 N2 O3 S |
| Smiles: | COc1ccc(cc1)N1C=C(C2=Cc3ccccc3OC2=O)NC1=S |
| Stereo: | ACHIRAL |
| logP: | 3.1843 |
| logD: | 3.1383 |
| logSw: | -3.7533 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.864 |
| InChI Key: | KWLZRKTWYBKMOT-UHFFFAOYSA-N |